USER MOD reduce.3.24.130724 H: found=0, std=0, add=886, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 887 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 802 ASN :FLIP amide:sc= 0.314 F(o=0.074,f=0.84) USER MOD Set 1.2: A 804 SER OG : rot 95:sc= 0.531 USER MOD Set 2.1: A 724 THR OG1 : rot -70:sc= -0.0306 USER MOD Set 2.2: A 774 ASN : amide:sc= 0.967 K(o=0.94,f=-0.16) USER MOD Set 3.1: A 714 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 732 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: A 728 HIS : no HD1:sc= -0.307 X(o=-6.3,f=-6.1!) USER MOD Set 4.2: A 740 GLN : amide:sc= -5.95! C(o=-6.3!,f=-6.1!) USER MOD Set 5.1: A 705 SER OG : rot 110:sc= 1.43 USER MOD Set 5.2: A 709 TYR OH : rot 180:sc= 0.505 USER MOD Single : A 690 THR OG1 : rot -19:sc= 0.122 USER MOD Single : A 699 HIS : no HD1:sc= -0.363 X(o=-0.36,f=0.044) USER MOD Single : A 703 GLN : amide:sc= -0.331 K(o=-0.33,f=-1.1) USER MOD Single : A 706 SER OG : rot 180:sc= 0 USER MOD Single : A 710 TYR OH : rot 180:sc= 0 USER MOD Single : A 711 TYR OH : rot 165:sc= -0.482 USER MOD Single : A 718 ASN : amide:sc= -0.845 X(o=-0.84,f=-0.64) USER MOD Single : A 720 SER OG : rot 180:sc= 0 USER MOD Single : A 722 SER OG : rot 180:sc= 0 USER MOD Single : A 725 MET CE :methyl 161:sc= -0.36 (180deg=-0.917) USER MOD Single : A 730 SER OG : rot 150:sc= 0.329 USER MOD Single : A 735 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 739 THR OG1 : rot 40:sc= -0.899! USER MOD Single : A 743 GLN :FLIP amide:sc= -0.447 F(o=-1.3,f=-0.45) USER MOD Single : A 749 LYS NZ :NH3+ -166:sc= 0 (180deg=-0.329) USER MOD Single : A 751 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0555) USER MOD Single : A 752 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 754 LYS NZ :NH3+ -140:sc= -0.143 (180deg=-0.511) USER MOD Single : A 755 SER OG : rot 180:sc= 0.0137 USER MOD Single : A 756 SER OG : rot 180:sc= 0 USER MOD Single : A 757 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 764 HIS : no HD1:sc= -0.906 K(o=-0.91,f=-3.6!) USER MOD Single : A 766 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 767 ASN : amide:sc= 0 X(o=0,f=-0.29) USER MOD Single : A 768 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 769 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 773 HIS : no HE2:sc= -7.13! C(o=-7.1!,f=-9!) USER MOD Single : A 775 SER OG : rot 91:sc= 0.611 USER MOD Single : A 776 ASN :FLIP amide:sc= -0.896 F(o=-2.5!,f=-0.9) USER MOD Single : A 779 TYR OH : rot 180:sc= 0 USER MOD Single : A 784 LYS NZ :NH3+ -152:sc= -0.215 (180deg=-0.874) USER MOD Single : A 789 HIS :FLIP no HD1:sc= -0.279 F(o=-1.2,f=-0.28) USER MOD Single : A 790 THR OG1 : rot 114:sc= -0.316! USER MOD Single : A 794 ASN :FLIP amide:sc= -8.07! C(o=-10!,f=-8.1!) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 690 28.721 -8.260 -2.120 1.00 0.00 N ATOM 2 CA THR A 690 27.953 -7.330 -1.331 1.00 0.00 C ATOM 3 C THR A 690 27.490 -6.215 -2.233 1.00 0.00 C ATOM 4 O THR A 690 28.255 -5.756 -3.093 1.00 0.00 O ATOM 5 CB THR A 690 28.782 -6.716 -0.139 1.00 0.00 C ATOM 6 OG1 THR A 690 30.086 -6.265 -0.583 1.00 0.00 O ATOM 7 CG2 THR A 690 28.948 -7.695 1.008 1.00 0.00 C ATOM 0 HA THR A 690 27.113 -7.871 -0.895 1.00 0.00 H new ATOM 0 HB THR A 690 28.211 -5.861 0.223 1.00 0.00 H new ATOM 0 HG1 THR A 690 30.307 -6.693 -1.437 1.00 0.00 H new ATOM 0 HG21 THR A 690 29.526 -7.227 1.805 1.00 0.00 H new ATOM 0 HG22 THR A 690 27.967 -7.979 1.389 1.00 0.00 H new ATOM 0 HG23 THR A 690 29.471 -8.584 0.655 1.00 0.00 H new ATOM 15 N CYS A 691 26.254 -5.820 -2.103 1.00 0.00 N ATOM 16 CA CYS A 691 25.772 -4.679 -2.839 1.00 0.00 C ATOM 17 C CYS A 691 26.460 -3.444 -2.301 1.00 0.00 C ATOM 18 O CYS A 691 27.278 -2.820 -2.981 1.00 0.00 O ATOM 19 CB CYS A 691 24.249 -4.553 -2.755 1.00 0.00 C ATOM 20 SG CYS A 691 23.347 -5.773 -3.766 1.00 0.00 S ATOM 0 H CYS A 691 25.564 -6.266 -1.499 1.00 0.00 H new ATOM 0 HA CYS A 691 26.008 -4.802 -3.896 1.00 0.00 H new ATOM 0 HB2 CYS A 691 23.943 -4.661 -1.715 1.00 0.00 H new ATOM 0 HB3 CYS A 691 23.960 -3.550 -3.070 1.00 0.00 H new ATOM 25 N GLY A 692 26.184 -3.128 -1.061 1.00 0.00 N ATOM 26 CA GLY A 692 26.853 -2.043 -0.435 1.00 0.00 C ATOM 27 C GLY A 692 26.106 -0.763 -0.525 1.00 0.00 C ATOM 28 O GLY A 692 25.594 -0.421 -1.588 1.00 0.00 O ATOM 0 H GLY A 692 25.502 -3.611 -0.477 1.00 0.00 H new ATOM 0 HA2 GLY A 692 27.021 -2.285 0.614 1.00 0.00 H new ATOM 0 HA3 GLY A 692 27.834 -1.917 -0.893 1.00 0.00 H new ATOM 32 N ASP A 693 26.051 -0.080 0.611 1.00 0.00 N ATOM 33 CA ASP A 693 25.387 1.222 0.812 1.00 0.00 C ATOM 34 C ASP A 693 23.993 1.290 0.213 1.00 0.00 C ATOM 35 O ASP A 693 23.815 1.466 -0.998 1.00 0.00 O ATOM 36 CB ASP A 693 26.265 2.388 0.353 1.00 0.00 C ATOM 37 CG ASP A 693 25.623 3.736 0.594 1.00 0.00 C ATOM 38 OD1 ASP A 693 25.335 4.075 1.756 1.00 0.00 O ATOM 39 OD2 ASP A 693 25.437 4.511 -0.382 1.00 0.00 O ATOM 0 H ASP A 693 26.487 -0.427 1.465 1.00 0.00 H new ATOM 0 HA ASP A 693 25.250 1.320 1.889 1.00 0.00 H new ATOM 0 HB2 ASP A 693 27.220 2.346 0.878 1.00 0.00 H new ATOM 0 HB3 ASP A 693 26.480 2.278 -0.710 1.00 0.00 H new ATOM 44 N ILE A 694 23.004 1.150 1.067 1.00 0.00 N ATOM 45 CA ILE A 694 21.625 1.165 0.638 1.00 0.00 C ATOM 46 C ILE A 694 21.246 2.483 -0.066 1.00 0.00 C ATOM 47 O ILE A 694 21.870 3.523 0.165 1.00 0.00 O ATOM 48 CB ILE A 694 20.618 0.841 1.798 1.00 0.00 C ATOM 49 CG1 ILE A 694 20.956 1.514 3.132 1.00 0.00 C ATOM 50 CG2 ILE A 694 20.473 -0.626 1.978 1.00 0.00 C ATOM 51 CD1 ILE A 694 20.933 3.002 3.147 1.00 0.00 C ATOM 0 H ILE A 694 23.132 1.023 2.071 1.00 0.00 H new ATOM 0 HA ILE A 694 21.540 0.360 -0.092 1.00 0.00 H new ATOM 0 HB ILE A 694 19.666 1.267 1.483 1.00 0.00 H new ATOM 0 HG12 ILE A 694 20.254 1.154 3.884 1.00 0.00 H new ATOM 0 HG13 ILE A 694 21.949 1.185 3.439 1.00 0.00 H new ATOM 0 HG21 ILE A 694 19.770 -0.826 2.787 1.00 0.00 H new ATOM 0 HG22 ILE A 694 20.100 -1.071 1.055 1.00 0.00 H new ATOM 0 HG23 ILE A 694 21.442 -1.060 2.224 1.00 0.00 H new ATOM 0 HD11 ILE A 694 21.188 3.360 4.144 1.00 0.00 H new ATOM 0 HD12 ILE A 694 21.657 3.384 2.428 1.00 0.00 H new ATOM 0 HD13 ILE A 694 19.936 3.353 2.880 1.00 0.00 H new ATOM 63 N PRO A 695 20.290 2.432 -0.976 1.00 0.00 N ATOM 64 CA PRO A 695 19.786 3.618 -1.672 1.00 0.00 C ATOM 65 C PRO A 695 19.006 4.572 -0.731 1.00 0.00 C ATOM 66 O PRO A 695 19.201 4.582 0.493 1.00 0.00 O ATOM 67 CB PRO A 695 18.844 3.016 -2.733 1.00 0.00 C ATOM 68 CG PRO A 695 18.462 1.689 -2.198 1.00 0.00 C ATOM 69 CD PRO A 695 19.650 1.204 -1.449 1.00 0.00 C ATOM 0 HA PRO A 695 20.590 4.229 -2.083 1.00 0.00 H new ATOM 0 HB2 PRO A 695 17.968 3.647 -2.887 1.00 0.00 H new ATOM 0 HB3 PRO A 695 19.343 2.924 -3.697 1.00 0.00 H new ATOM 0 HG2 PRO A 695 17.592 1.765 -1.546 1.00 0.00 H new ATOM 0 HG3 PRO A 695 18.199 1.003 -3.003 1.00 0.00 H new ATOM 0 HD2 PRO A 695 19.363 0.557 -0.620 1.00 0.00 H new ATOM 0 HD3 PRO A 695 20.317 0.626 -2.088 1.00 0.00 H new ATOM 77 N GLU A 696 18.168 5.370 -1.305 1.00 0.00 N ATOM 78 CA GLU A 696 17.351 6.270 -0.610 1.00 0.00 C ATOM 79 C GLU A 696 15.987 6.120 -1.209 1.00 0.00 C ATOM 80 O GLU A 696 15.847 5.572 -2.316 1.00 0.00 O ATOM 81 CB GLU A 696 17.860 7.713 -0.786 1.00 0.00 C ATOM 82 CG GLU A 696 17.873 8.192 -2.234 1.00 0.00 C ATOM 83 CD GLU A 696 18.399 9.589 -2.394 1.00 0.00 C ATOM 84 OE1 GLU A 696 17.599 10.551 -2.351 1.00 0.00 O ATOM 85 OE2 GLU A 696 19.630 9.755 -2.596 1.00 0.00 O ATOM 0 H GLU A 696 18.039 5.403 -2.316 1.00 0.00 H new ATOM 0 HA GLU A 696 17.348 6.065 0.460 1.00 0.00 H new ATOM 0 HB2 GLU A 696 17.233 8.383 -0.198 1.00 0.00 H new ATOM 0 HB3 GLU A 696 18.870 7.784 -0.381 1.00 0.00 H new ATOM 0 HG2 GLU A 696 18.483 7.512 -2.829 1.00 0.00 H new ATOM 0 HG3 GLU A 696 16.860 8.145 -2.634 1.00 0.00 H new ATOM 92 N LEU A 697 15.026 6.537 -0.511 1.00 0.00 N ATOM 93 CA LEU A 697 13.685 6.498 -0.990 1.00 0.00 C ATOM 94 C LEU A 697 13.345 7.876 -1.501 1.00 0.00 C ATOM 95 O LEU A 697 13.633 8.879 -0.833 1.00 0.00 O ATOM 96 CB LEU A 697 12.699 6.111 0.117 1.00 0.00 C ATOM 97 CG LEU A 697 11.669 5.014 -0.234 1.00 0.00 C ATOM 98 CD1 LEU A 697 10.635 4.884 0.824 1.00 0.00 C ATOM 99 CD2 LEU A 697 11.036 5.204 -1.601 1.00 0.00 C ATOM 0 H LEU A 697 15.128 6.925 0.427 1.00 0.00 H new ATOM 0 HA LEU A 697 13.606 5.747 -1.776 1.00 0.00 H new ATOM 0 HB2 LEU A 697 13.271 5.778 0.983 1.00 0.00 H new ATOM 0 HB3 LEU A 697 12.155 7.006 0.419 1.00 0.00 H new ATOM 0 HG LEU A 697 12.227 4.079 -0.283 1.00 0.00 H new ATOM 0 HD11 LEU A 697 9.926 4.104 0.546 1.00 0.00 H new ATOM 0 HD12 LEU A 697 11.112 4.621 1.768 1.00 0.00 H new ATOM 0 HD13 LEU A 697 10.107 5.831 0.935 1.00 0.00 H new ATOM 0 HD21 LEU A 697 10.323 4.401 -1.786 1.00 0.00 H new ATOM 0 HD22 LEU A 697 10.519 6.163 -1.632 1.00 0.00 H new ATOM 0 HD23 LEU A 697 11.811 5.185 -2.367 1.00 0.00 H new ATOM 111 N GLU A 698 12.765 7.918 -2.675 1.00 0.00 N ATOM 112 CA GLU A 698 12.345 9.144 -3.343 1.00 0.00 C ATOM 113 C GLU A 698 11.530 10.085 -2.448 1.00 0.00 C ATOM 114 O GLU A 698 11.689 11.303 -2.522 1.00 0.00 O ATOM 115 CB GLU A 698 11.550 8.806 -4.605 1.00 0.00 C ATOM 116 CG GLU A 698 10.475 7.748 -4.381 1.00 0.00 C ATOM 117 CD GLU A 698 9.609 7.524 -5.581 1.00 0.00 C ATOM 118 OE1 GLU A 698 10.081 6.941 -6.586 1.00 0.00 O ATOM 119 OE2 GLU A 698 8.445 7.905 -5.536 1.00 0.00 O ATOM 0 H GLU A 698 12.562 7.078 -3.216 1.00 0.00 H new ATOM 0 HA GLU A 698 13.258 9.680 -3.602 1.00 0.00 H new ATOM 0 HB2 GLU A 698 11.081 9.714 -4.984 1.00 0.00 H new ATOM 0 HB3 GLU A 698 12.237 8.457 -5.375 1.00 0.00 H new ATOM 0 HG2 GLU A 698 10.952 6.808 -4.105 1.00 0.00 H new ATOM 0 HG3 GLU A 698 9.849 8.047 -3.540 1.00 0.00 H new ATOM 126 N HIS A 699 10.646 9.529 -1.623 1.00 0.00 N ATOM 127 CA HIS A 699 9.785 10.353 -0.758 1.00 0.00 C ATOM 128 C HIS A 699 9.587 9.675 0.586 1.00 0.00 C ATOM 129 O HIS A 699 8.580 9.882 1.260 1.00 0.00 O ATOM 130 CB HIS A 699 8.400 10.578 -1.400 1.00 0.00 C ATOM 131 CG HIS A 699 8.406 11.247 -2.737 1.00 0.00 C ATOM 132 ND1 HIS A 699 8.420 12.607 -2.918 1.00 0.00 N ATOM 133 CD2 HIS A 699 8.400 10.710 -3.968 1.00 0.00 C ATOM 134 CE1 HIS A 699 8.416 12.873 -4.204 1.00 0.00 C ATOM 135 NE2 HIS A 699 8.405 11.733 -4.864 1.00 0.00 N ATOM 0 H HIS A 699 10.503 8.523 -1.530 1.00 0.00 H new ATOM 0 HA HIS A 699 10.281 11.315 -0.626 1.00 0.00 H new ATOM 0 HB2 HIS A 699 7.905 9.612 -1.500 1.00 0.00 H new ATOM 0 HB3 HIS A 699 7.796 11.176 -0.718 1.00 0.00 H new ATOM 0 HD2 HIS A 699 8.393 9.656 -4.204 1.00 0.00 H new ATOM 0 HE1 HIS A 699 8.421 13.859 -4.645 1.00 0.00 H new ATOM 0 HE2 HIS A 699 8.401 11.634 -5.879 1.00 0.00 H new ATOM 144 N GLY A 700 10.545 8.893 0.983 1.00 0.00 N ATOM 145 CA GLY A 700 10.428 8.167 2.222 1.00 0.00 C ATOM 146 C GLY A 700 11.727 8.105 2.962 1.00 0.00 C ATOM 147 O GLY A 700 12.535 9.030 2.879 1.00 0.00 O ATOM 0 H GLY A 700 11.415 8.738 0.473 1.00 0.00 H new ATOM 0 HA2 GLY A 700 9.675 8.643 2.851 1.00 0.00 H new ATOM 0 HA3 GLY A 700 10.079 7.155 2.017 1.00 0.00 H new ATOM 151 N TRP A 701 11.951 7.019 3.640 1.00 0.00 N ATOM 152 CA TRP A 701 13.132 6.845 4.468 1.00 0.00 C ATOM 153 C TRP A 701 13.489 5.371 4.535 1.00 0.00 C ATOM 154 O TRP A 701 12.824 4.545 3.918 1.00 0.00 O ATOM 155 CB TRP A 701 12.859 7.385 5.905 1.00 0.00 C ATOM 156 CG TRP A 701 11.731 6.680 6.658 1.00 0.00 C ATOM 157 CD1 TRP A 701 10.902 5.698 6.189 1.00 0.00 C ATOM 158 CD2 TRP A 701 11.323 6.912 8.013 1.00 0.00 C ATOM 159 NE1 TRP A 701 10.019 5.324 7.154 1.00 0.00 N ATOM 160 CE2 TRP A 701 10.249 6.045 8.272 1.00 0.00 C ATOM 161 CE3 TRP A 701 11.752 7.764 9.030 1.00 0.00 C ATOM 162 CZ2 TRP A 701 9.599 5.997 9.484 1.00 0.00 C ATOM 163 CZ3 TRP A 701 11.100 7.716 10.251 1.00 0.00 C ATOM 164 CH2 TRP A 701 10.033 6.837 10.468 1.00 0.00 C ATOM 0 H TRP A 701 11.321 6.216 3.642 1.00 0.00 H new ATOM 0 HA TRP A 701 13.962 7.401 4.032 1.00 0.00 H new ATOM 0 HB2 TRP A 701 13.775 7.298 6.489 1.00 0.00 H new ATOM 0 HB3 TRP A 701 12.623 8.447 5.839 1.00 0.00 H new ATOM 0 HD1 TRP A 701 10.943 5.279 5.194 1.00 0.00 H new ATOM 0 HE1 TRP A 701 9.297 4.611 7.049 1.00 0.00 H new ATOM 0 HE3 TRP A 701 12.574 8.446 8.869 1.00 0.00 H new ATOM 0 HZ2 TRP A 701 8.775 5.319 9.650 1.00 0.00 H new ATOM 0 HZ3 TRP A 701 11.421 8.368 11.050 1.00 0.00 H new ATOM 0 HH2 TRP A 701 9.544 6.823 11.431 1.00 0.00 H new ATOM 175 N ALA A 702 14.477 5.051 5.317 1.00 0.00 N ATOM 176 CA ALA A 702 14.860 3.693 5.547 1.00 0.00 C ATOM 177 C ALA A 702 14.670 3.385 7.021 1.00 0.00 C ATOM 178 O ALA A 702 14.876 4.260 7.875 1.00 0.00 O ATOM 179 CB ALA A 702 16.311 3.472 5.145 1.00 0.00 C ATOM 0 H ALA A 702 15.045 5.734 5.818 1.00 0.00 H new ATOM 0 HA ALA A 702 14.241 3.029 4.944 1.00 0.00 H new ATOM 0 HB1 ALA A 702 16.585 2.433 5.327 1.00 0.00 H new ATOM 0 HB2 ALA A 702 16.434 3.699 4.086 1.00 0.00 H new ATOM 0 HB3 ALA A 702 16.955 4.125 5.733 1.00 0.00 H new ATOM 185 N GLN A 703 14.235 2.185 7.320 1.00 0.00 N ATOM 186 CA GLN A 703 14.086 1.757 8.691 1.00 0.00 C ATOM 187 C GLN A 703 15.444 1.476 9.320 1.00 0.00 C ATOM 188 O GLN A 703 15.997 2.305 10.034 1.00 0.00 O ATOM 189 CB GLN A 703 13.162 0.541 8.798 1.00 0.00 C ATOM 190 CG GLN A 703 11.699 0.908 8.980 1.00 0.00 C ATOM 191 CD GLN A 703 11.474 1.673 10.284 1.00 0.00 C ATOM 192 OE1 GLN A 703 12.201 1.473 11.263 1.00 0.00 O ATOM 193 NE2 GLN A 703 10.488 2.535 10.326 1.00 0.00 N ATOM 0 H GLN A 703 13.976 1.483 6.627 1.00 0.00 H new ATOM 0 HA GLN A 703 13.619 2.570 9.247 1.00 0.00 H new ATOM 0 HB2 GLN A 703 13.267 -0.066 7.899 1.00 0.00 H new ATOM 0 HB3 GLN A 703 13.481 -0.076 9.638 1.00 0.00 H new ATOM 0 HG2 GLN A 703 11.367 1.516 8.138 1.00 0.00 H new ATOM 0 HG3 GLN A 703 11.092 0.003 8.978 1.00 0.00 H new ATOM 0 HE21 GLN A 703 9.903 2.681 9.503 1.00 0.00 H new ATOM 0 HE22 GLN A 703 10.306 3.060 11.181 1.00 0.00 H new ATOM 202 N LEU A 704 15.995 0.346 9.006 1.00 0.00 N ATOM 203 CA LEU A 704 17.292 -0.038 9.475 1.00 0.00 C ATOM 204 C LEU A 704 17.857 -0.913 8.402 1.00 0.00 C ATOM 205 O LEU A 704 17.172 -1.804 7.911 1.00 0.00 O ATOM 206 CB LEU A 704 17.185 -0.770 10.843 1.00 0.00 C ATOM 207 CG LEU A 704 18.490 -1.042 11.641 1.00 0.00 C ATOM 208 CD1 LEU A 704 18.143 -1.469 13.050 1.00 0.00 C ATOM 209 CD2 LEU A 704 19.343 -2.131 11.001 1.00 0.00 C ATOM 0 H LEU A 704 15.550 -0.349 8.406 1.00 0.00 H new ATOM 0 HA LEU A 704 17.941 0.819 9.655 1.00 0.00 H new ATOM 0 HB2 LEU A 704 16.522 -0.186 11.481 1.00 0.00 H new ATOM 0 HB3 LEU A 704 16.697 -1.729 10.669 1.00 0.00 H new ATOM 0 HG LEU A 704 19.065 -0.116 11.643 1.00 0.00 H new ATOM 0 HD11 LEU A 704 19.059 -1.659 13.609 1.00 0.00 H new ATOM 0 HD12 LEU A 704 17.577 -0.678 13.541 1.00 0.00 H new ATOM 0 HD13 LEU A 704 17.543 -2.378 13.017 1.00 0.00 H new ATOM 0 HD21 LEU A 704 20.244 -2.284 11.596 1.00 0.00 H new ATOM 0 HD22 LEU A 704 18.774 -3.060 10.957 1.00 0.00 H new ATOM 0 HD23 LEU A 704 19.622 -1.829 9.992 1.00 0.00 H new ATOM 221 N SER A 705 19.039 -0.638 8.001 1.00 0.00 N ATOM 222 CA SER A 705 19.632 -1.343 6.949 1.00 0.00 C ATOM 223 C SER A 705 20.876 -2.069 7.448 1.00 0.00 C ATOM 224 O SER A 705 20.858 -3.290 7.629 1.00 0.00 O ATOM 225 CB SER A 705 19.893 -0.347 5.814 1.00 0.00 C ATOM 226 OG SER A 705 20.714 0.740 6.248 1.00 0.00 O ATOM 0 H SER A 705 19.624 0.094 8.404 1.00 0.00 H new ATOM 0 HA SER A 705 18.983 -2.126 6.557 1.00 0.00 H new ATOM 0 HB2 SER A 705 20.377 -0.860 4.983 1.00 0.00 H new ATOM 0 HB3 SER A 705 18.944 0.039 5.442 1.00 0.00 H new ATOM 0 HG SER A 705 21.600 0.665 5.836 1.00 0.00 H new ATOM 232 N SER A 706 21.893 -1.291 7.738 1.00 0.00 N ATOM 233 CA SER A 706 23.186 -1.735 8.265 1.00 0.00 C ATOM 234 C SER A 706 23.959 -2.643 7.264 1.00 0.00 C ATOM 235 O SER A 706 23.435 -3.658 6.777 1.00 0.00 O ATOM 236 CB SER A 706 23.017 -2.412 9.639 1.00 0.00 C ATOM 237 OG SER A 706 24.277 -2.701 10.253 1.00 0.00 O ATOM 0 H SER A 706 21.850 -0.280 7.611 1.00 0.00 H new ATOM 0 HA SER A 706 23.799 -0.845 8.402 1.00 0.00 H new ATOM 0 HB2 SER A 706 22.435 -1.763 10.294 1.00 0.00 H new ATOM 0 HB3 SER A 706 22.451 -3.336 9.521 1.00 0.00 H new ATOM 0 HG SER A 706 24.127 -3.128 11.122 1.00 0.00 H new ATOM 243 N PRO A 707 25.206 -2.253 6.917 1.00 0.00 N ATOM 244 CA PRO A 707 26.083 -3.032 6.015 1.00 0.00 C ATOM 245 C PRO A 707 26.446 -4.407 6.619 1.00 0.00 C ATOM 246 O PRO A 707 26.104 -4.689 7.775 1.00 0.00 O ATOM 247 CB PRO A 707 27.309 -2.124 5.855 1.00 0.00 C ATOM 248 CG PRO A 707 27.304 -1.267 7.066 1.00 0.00 C ATOM 249 CD PRO A 707 25.864 -1.013 7.373 1.00 0.00 C ATOM 0 HA PRO A 707 25.613 -3.275 5.062 1.00 0.00 H new ATOM 0 HB2 PRO A 707 28.227 -2.707 5.786 1.00 0.00 H new ATOM 0 HB3 PRO A 707 27.243 -1.526 4.946 1.00 0.00 H new ATOM 0 HG2 PRO A 707 27.801 -1.764 7.900 1.00 0.00 H new ATOM 0 HG3 PRO A 707 27.837 -0.333 6.888 1.00 0.00 H new ATOM 0 HD2 PRO A 707 25.703 -0.838 8.437 1.00 0.00 H new ATOM 0 HD3 PRO A 707 25.487 -0.138 6.845 1.00 0.00 H new ATOM 257 N PRO A 708 27.174 -5.281 5.893 1.00 0.00 N ATOM 258 CA PRO A 708 27.777 -5.010 4.565 1.00 0.00 C ATOM 259 C PRO A 708 26.816 -5.055 3.409 1.00 0.00 C ATOM 260 O PRO A 708 27.195 -4.695 2.283 1.00 0.00 O ATOM 261 CB PRO A 708 28.786 -6.117 4.389 1.00 0.00 C ATOM 262 CG PRO A 708 28.759 -6.912 5.644 1.00 0.00 C ATOM 263 CD PRO A 708 27.468 -6.632 6.322 1.00 0.00 C ATOM 0 HA PRO A 708 28.180 -3.997 4.554 1.00 0.00 H new ATOM 0 HB2 PRO A 708 28.535 -6.739 3.530 1.00 0.00 H new ATOM 0 HB3 PRO A 708 29.781 -5.711 4.208 1.00 0.00 H new ATOM 0 HG2 PRO A 708 28.855 -7.976 5.426 1.00 0.00 H new ATOM 0 HG3 PRO A 708 29.596 -6.642 6.287 1.00 0.00 H new ATOM 0 HD2 PRO A 708 26.690 -7.332 6.018 1.00 0.00 H new ATOM 0 HD3 PRO A 708 27.555 -6.703 7.406 1.00 0.00 H new ATOM 271 N TYR A 709 25.613 -5.530 3.671 1.00 0.00 N ATOM 272 CA TYR A 709 24.540 -5.602 2.679 1.00 0.00 C ATOM 273 C TYR A 709 24.836 -6.714 1.666 1.00 0.00 C ATOM 274 O TYR A 709 25.350 -6.457 0.561 1.00 0.00 O ATOM 275 CB TYR A 709 24.337 -4.257 1.935 1.00 0.00 C ATOM 276 CG TYR A 709 24.009 -3.056 2.798 1.00 0.00 C ATOM 277 CD1 TYR A 709 22.858 -2.989 3.546 1.00 0.00 C ATOM 278 CD2 TYR A 709 24.872 -1.985 2.852 1.00 0.00 C ATOM 279 CE1 TYR A 709 22.584 -1.894 4.320 1.00 0.00 C ATOM 280 CE2 TYR A 709 24.602 -0.880 3.623 1.00 0.00 C ATOM 281 CZ TYR A 709 23.461 -0.838 4.354 1.00 0.00 C ATOM 282 OH TYR A 709 23.192 0.266 5.141 1.00 0.00 O ATOM 0 H TYR A 709 25.343 -5.883 4.589 1.00 0.00 H new ATOM 0 HA TYR A 709 23.617 -5.824 3.215 1.00 0.00 H new ATOM 0 HB2 TYR A 709 25.244 -4.037 1.373 1.00 0.00 H new ATOM 0 HB3 TYR A 709 23.535 -4.386 1.208 1.00 0.00 H new ATOM 0 HD1 TYR A 709 22.160 -3.812 3.523 1.00 0.00 H new ATOM 0 HD2 TYR A 709 25.784 -2.014 2.274 1.00 0.00 H new ATOM 0 HE1 TYR A 709 21.677 -1.860 4.905 1.00 0.00 H new ATOM 0 HE2 TYR A 709 25.294 -0.051 3.646 1.00 0.00 H new ATOM 0 HH TYR A 709 23.917 0.919 5.048 1.00 0.00 H new ATOM 292 N TYR A 710 24.578 -7.929 2.064 1.00 0.00 N ATOM 293 CA TYR A 710 24.831 -9.093 1.242 1.00 0.00 C ATOM 294 C TYR A 710 23.699 -9.392 0.310 1.00 0.00 C ATOM 295 O TYR A 710 22.617 -8.791 0.391 1.00 0.00 O ATOM 296 CB TYR A 710 25.108 -10.332 2.095 1.00 0.00 C ATOM 297 CG TYR A 710 26.515 -10.441 2.561 1.00 0.00 C ATOM 298 CD1 TYR A 710 27.452 -11.029 1.751 1.00 0.00 C ATOM 299 CD2 TYR A 710 26.918 -9.958 3.784 1.00 0.00 C ATOM 300 CE1 TYR A 710 28.754 -11.136 2.128 1.00 0.00 C ATOM 301 CE2 TYR A 710 28.233 -10.057 4.176 1.00 0.00 C ATOM 302 CZ TYR A 710 29.147 -10.649 3.338 1.00 0.00 C ATOM 303 OH TYR A 710 30.471 -10.735 3.704 1.00 0.00 O ATOM 0 H TYR A 710 24.181 -8.148 2.978 1.00 0.00 H new ATOM 0 HA TYR A 710 25.714 -8.851 0.650 1.00 0.00 H new ATOM 0 HB2 TYR A 710 24.448 -10.318 2.963 1.00 0.00 H new ATOM 0 HB3 TYR A 710 24.857 -11.222 1.518 1.00 0.00 H new ATOM 0 HD1 TYR A 710 27.148 -11.417 0.790 1.00 0.00 H new ATOM 0 HD2 TYR A 710 26.196 -9.497 4.442 1.00 0.00 H new ATOM 0 HE1 TYR A 710 29.473 -11.604 1.472 1.00 0.00 H new ATOM 0 HE2 TYR A 710 28.545 -9.672 5.136 1.00 0.00 H new ATOM 0 HH TYR A 710 30.591 -10.343 4.594 1.00 0.00 H new ATOM 313 N TYR A 711 23.946 -10.325 -0.574 1.00 0.00 N ATOM 314 CA TYR A 711 22.946 -10.779 -1.486 1.00 0.00 C ATOM 315 C TYR A 711 21.867 -11.500 -0.735 1.00 0.00 C ATOM 316 O TYR A 711 22.135 -12.325 0.161 1.00 0.00 O ATOM 317 CB TYR A 711 23.527 -11.667 -2.565 1.00 0.00 C ATOM 318 CG TYR A 711 24.358 -10.935 -3.588 1.00 0.00 C ATOM 319 CD1 TYR A 711 25.649 -10.487 -3.312 1.00 0.00 C ATOM 320 CD2 TYR A 711 23.844 -10.698 -4.847 1.00 0.00 C ATOM 321 CE1 TYR A 711 26.387 -9.831 -4.266 1.00 0.00 C ATOM 322 CE2 TYR A 711 24.587 -10.048 -5.808 1.00 0.00 C ATOM 323 CZ TYR A 711 25.862 -9.617 -5.508 1.00 0.00 C ATOM 324 OH TYR A 711 26.623 -8.981 -6.467 1.00 0.00 O ATOM 0 H TYR A 711 24.850 -10.787 -0.676 1.00 0.00 H new ATOM 0 HA TYR A 711 22.521 -9.907 -1.983 1.00 0.00 H new ATOM 0 HB2 TYR A 711 24.142 -12.435 -2.096 1.00 0.00 H new ATOM 0 HB3 TYR A 711 22.712 -12.180 -3.075 1.00 0.00 H new ATOM 0 HD1 TYR A 711 26.074 -10.658 -2.334 1.00 0.00 H new ATOM 0 HD2 TYR A 711 22.843 -11.028 -5.083 1.00 0.00 H new ATOM 0 HE1 TYR A 711 27.383 -9.484 -4.034 1.00 0.00 H new ATOM 0 HE2 TYR A 711 24.173 -9.877 -6.791 1.00 0.00 H new ATOM 0 HH TYR A 711 26.217 -9.114 -7.349 1.00 0.00 H new ATOM 334 N GLY A 712 20.664 -11.160 -1.055 1.00 0.00 N ATOM 335 CA GLY A 712 19.547 -11.728 -0.391 1.00 0.00 C ATOM 336 C GLY A 712 19.066 -10.835 0.732 1.00 0.00 C ATOM 337 O GLY A 712 18.000 -11.061 1.306 1.00 0.00 O ATOM 0 H GLY A 712 20.431 -10.483 -1.782 1.00 0.00 H new ATOM 0 HA2 GLY A 712 18.739 -11.887 -1.105 1.00 0.00 H new ATOM 0 HA3 GLY A 712 19.816 -12.706 0.008 1.00 0.00 H new ATOM 341 N ASP A 713 19.853 -9.819 1.077 1.00 0.00 N ATOM 342 CA ASP A 713 19.440 -8.890 2.112 1.00 0.00 C ATOM 343 C ASP A 713 18.375 -7.974 1.605 1.00 0.00 C ATOM 344 O ASP A 713 18.352 -7.616 0.418 1.00 0.00 O ATOM 345 CB ASP A 713 20.594 -8.087 2.736 1.00 0.00 C ATOM 346 CG ASP A 713 21.323 -8.833 3.847 1.00 0.00 C ATOM 347 OD1 ASP A 713 20.675 -9.168 4.874 1.00 0.00 O ATOM 348 OD2 ASP A 713 22.551 -9.045 3.762 1.00 0.00 O ATOM 0 H ASP A 713 20.764 -9.624 0.661 1.00 0.00 H new ATOM 0 HA ASP A 713 19.040 -9.506 2.917 1.00 0.00 H new ATOM 0 HB2 ASP A 713 21.308 -7.826 1.955 1.00 0.00 H new ATOM 0 HB3 ASP A 713 20.201 -7.151 3.134 1.00 0.00 H new ATOM 353 N SER A 714 17.476 -7.624 2.471 1.00 0.00 N ATOM 354 CA SER A 714 16.384 -6.764 2.128 1.00 0.00 C ATOM 355 C SER A 714 16.281 -5.662 3.160 1.00 0.00 C ATOM 356 O SER A 714 16.671 -5.857 4.310 1.00 0.00 O ATOM 357 CB SER A 714 15.095 -7.550 2.096 1.00 0.00 C ATOM 358 OG SER A 714 15.220 -8.734 1.302 1.00 0.00 O ATOM 0 H SER A 714 17.478 -7.929 3.444 1.00 0.00 H new ATOM 0 HA SER A 714 16.558 -6.334 1.142 1.00 0.00 H new ATOM 0 HB2 SER A 714 14.808 -7.821 3.112 1.00 0.00 H new ATOM 0 HB3 SER A 714 14.297 -6.925 1.695 1.00 0.00 H new ATOM 0 HG SER A 714 14.369 -9.220 1.304 1.00 0.00 H new ATOM 364 N VAL A 715 15.790 -4.514 2.762 1.00 0.00 N ATOM 365 CA VAL A 715 15.696 -3.375 3.669 1.00 0.00 C ATOM 366 C VAL A 715 14.347 -2.715 3.534 1.00 0.00 C ATOM 367 O VAL A 715 13.833 -2.597 2.425 1.00 0.00 O ATOM 368 CB VAL A 715 16.777 -2.316 3.349 1.00 0.00 C ATOM 369 CG1 VAL A 715 16.775 -1.193 4.381 1.00 0.00 C ATOM 370 CG2 VAL A 715 18.139 -2.950 3.267 1.00 0.00 C ATOM 0 H VAL A 715 15.447 -4.334 1.818 1.00 0.00 H new ATOM 0 HA VAL A 715 15.841 -3.752 4.681 1.00 0.00 H new ATOM 0 HB VAL A 715 16.537 -1.883 2.378 1.00 0.00 H new ATOM 0 HG11 VAL A 715 17.546 -0.465 4.128 1.00 0.00 H new ATOM 0 HG12 VAL A 715 15.801 -0.704 4.384 1.00 0.00 H new ATOM 0 HG13 VAL A 715 16.977 -1.607 5.369 1.00 0.00 H new ATOM 0 HG21 VAL A 715 18.883 -2.186 3.041 1.00 0.00 H new ATOM 0 HG22 VAL A 715 18.380 -3.420 4.221 1.00 0.00 H new ATOM 0 HG23 VAL A 715 18.143 -3.704 2.480 1.00 0.00 H new ATOM 380 N GLU A 716 13.791 -2.309 4.649 1.00 0.00 N ATOM 381 CA GLU A 716 12.543 -1.609 4.685 1.00 0.00 C ATOM 382 C GLU A 716 12.733 -0.122 4.488 1.00 0.00 C ATOM 383 O GLU A 716 13.469 0.549 5.228 1.00 0.00 O ATOM 384 CB GLU A 716 11.812 -1.836 5.990 1.00 0.00 C ATOM 385 CG GLU A 716 11.364 -3.248 6.223 1.00 0.00 C ATOM 386 CD GLU A 716 10.553 -3.353 7.471 1.00 0.00 C ATOM 387 OE1 GLU A 716 9.341 -3.057 7.428 1.00 0.00 O ATOM 388 OE2 GLU A 716 11.101 -3.734 8.524 1.00 0.00 O ATOM 0 H GLU A 716 14.205 -2.461 5.569 1.00 0.00 H new ATOM 0 HA GLU A 716 11.946 -2.008 3.865 1.00 0.00 H new ATOM 0 HB2 GLU A 716 12.463 -1.536 6.811 1.00 0.00 H new ATOM 0 HB3 GLU A 716 10.939 -1.183 6.020 1.00 0.00 H new ATOM 0 HG2 GLU A 716 10.775 -3.591 5.372 1.00 0.00 H new ATOM 0 HG3 GLU A 716 12.233 -3.902 6.294 1.00 0.00 H new ATOM 395 N PHE A 717 12.071 0.354 3.511 1.00 0.00 N ATOM 396 CA PHE A 717 11.979 1.723 3.158 1.00 0.00 C ATOM 397 C PHE A 717 10.509 2.056 3.131 1.00 0.00 C ATOM 398 O PHE A 717 9.786 1.623 2.243 1.00 0.00 O ATOM 399 CB PHE A 717 12.601 1.985 1.773 1.00 0.00 C ATOM 400 CG PHE A 717 14.099 2.117 1.741 1.00 0.00 C ATOM 401 CD1 PHE A 717 14.926 1.064 2.069 1.00 0.00 C ATOM 402 CD2 PHE A 717 14.677 3.317 1.370 1.00 0.00 C ATOM 403 CE1 PHE A 717 16.298 1.209 2.027 1.00 0.00 C ATOM 404 CE2 PHE A 717 16.044 3.464 1.325 1.00 0.00 C ATOM 405 CZ PHE A 717 16.858 2.407 1.652 1.00 0.00 C ATOM 0 H PHE A 717 11.535 -0.245 2.884 1.00 0.00 H new ATOM 0 HA PHE A 717 12.522 2.340 3.874 1.00 0.00 H new ATOM 0 HB2 PHE A 717 12.313 1.172 1.107 1.00 0.00 H new ATOM 0 HB3 PHE A 717 12.166 2.899 1.368 1.00 0.00 H new ATOM 0 HD1 PHE A 717 14.497 0.117 2.361 1.00 0.00 H new ATOM 0 HD2 PHE A 717 14.044 4.153 1.111 1.00 0.00 H new ATOM 0 HE1 PHE A 717 16.935 0.377 2.290 1.00 0.00 H new ATOM 0 HE2 PHE A 717 16.477 4.409 1.033 1.00 0.00 H new ATOM 0 HZ PHE A 717 17.932 2.517 1.615 1.00 0.00 H new ATOM 415 N ASN A 718 10.054 2.756 4.117 1.00 0.00 N ATOM 416 CA ASN A 718 8.649 3.094 4.181 1.00 0.00 C ATOM 417 C ASN A 718 8.549 4.578 4.012 1.00 0.00 C ATOM 418 O ASN A 718 9.512 5.232 3.611 1.00 0.00 O ATOM 419 CB ASN A 718 7.999 2.700 5.534 1.00 0.00 C ATOM 420 CG ASN A 718 8.319 1.304 6.014 1.00 0.00 C ATOM 421 OD1 ASN A 718 7.672 0.329 5.660 1.00 0.00 O ATOM 422 ND2 ASN A 718 9.256 1.232 6.909 1.00 0.00 N ATOM 0 H ASN A 718 10.620 3.108 4.889 1.00 0.00 H new ATOM 0 HA ASN A 718 8.120 2.545 3.402 1.00 0.00 H new ATOM 0 HB2 ASN A 718 8.320 3.412 6.295 1.00 0.00 H new ATOM 0 HB3 ASN A 718 6.917 2.797 5.442 1.00 0.00 H new ATOM 0 HD21 ASN A 718 9.476 0.337 7.346 1.00 0.00 H new ATOM 0 HD22 ASN A 718 9.772 2.070 7.176 1.00 0.00 H new ATOM 429 N CYS A 719 7.458 5.124 4.369 1.00 0.00 N ATOM 430 CA CYS A 719 7.267 6.528 4.215 1.00 0.00 C ATOM 431 C CYS A 719 7.181 7.088 5.601 1.00 0.00 C ATOM 432 O CYS A 719 6.515 6.502 6.460 1.00 0.00 O ATOM 433 CB CYS A 719 6.009 6.801 3.390 1.00 0.00 C ATOM 434 SG CYS A 719 5.844 5.672 1.967 1.00 0.00 S ATOM 0 H CYS A 719 6.667 4.624 4.776 1.00 0.00 H new ATOM 0 HA CYS A 719 8.085 7.002 3.673 1.00 0.00 H new ATOM 0 HB2 CYS A 719 5.132 6.704 4.029 1.00 0.00 H new ATOM 0 HB3 CYS A 719 6.030 7.830 3.032 1.00 0.00 H new ATOM 439 N SER A 720 7.871 8.165 5.834 1.00 0.00 N ATOM 440 CA SER A 720 8.000 8.727 7.171 1.00 0.00 C ATOM 441 C SER A 720 6.652 9.227 7.683 1.00 0.00 C ATOM 442 O SER A 720 6.104 8.701 8.652 1.00 0.00 O ATOM 443 CB SER A 720 9.061 9.851 7.157 1.00 0.00 C ATOM 444 OG SER A 720 9.282 10.439 8.438 1.00 0.00 O ATOM 0 H SER A 720 8.365 8.688 5.111 1.00 0.00 H new ATOM 0 HA SER A 720 8.332 7.949 7.859 1.00 0.00 H new ATOM 0 HB2 SER A 720 10.002 9.447 6.784 1.00 0.00 H new ATOM 0 HB3 SER A 720 8.748 10.627 6.459 1.00 0.00 H new ATOM 0 HG SER A 720 9.963 11.140 8.363 1.00 0.00 H new ATOM 450 N GLU A 721 6.129 10.203 7.023 1.00 0.00 N ATOM 451 CA GLU A 721 4.879 10.810 7.359 1.00 0.00 C ATOM 452 C GLU A 721 4.484 11.596 6.166 1.00 0.00 C ATOM 453 O GLU A 721 5.352 11.896 5.358 1.00 0.00 O ATOM 454 CB GLU A 721 5.036 11.725 8.580 1.00 0.00 C ATOM 455 CG GLU A 721 6.118 12.780 8.422 1.00 0.00 C ATOM 456 CD GLU A 721 6.279 13.621 9.644 1.00 0.00 C ATOM 457 OE1 GLU A 721 6.934 13.169 10.603 1.00 0.00 O ATOM 458 OE2 GLU A 721 5.748 14.754 9.673 1.00 0.00 O ATOM 0 H GLU A 721 6.573 10.618 6.204 1.00 0.00 H new ATOM 0 HA GLU A 721 4.126 10.065 7.618 1.00 0.00 H new ATOM 0 HB2 GLU A 721 4.085 12.220 8.776 1.00 0.00 H new ATOM 0 HB3 GLU A 721 5.263 11.114 9.453 1.00 0.00 H new ATOM 0 HG2 GLU A 721 7.066 12.292 8.193 1.00 0.00 H new ATOM 0 HG3 GLU A 721 5.876 13.420 7.574 1.00 0.00 H new ATOM 465 N SER A 722 3.196 11.858 6.009 1.00 0.00 N ATOM 466 CA SER A 722 2.664 12.638 4.890 1.00 0.00 C ATOM 467 C SER A 722 2.756 11.907 3.549 1.00 0.00 C ATOM 468 O SER A 722 2.346 12.425 2.523 1.00 0.00 O ATOM 469 CB SER A 722 3.355 13.983 4.809 1.00 0.00 C ATOM 470 OG SER A 722 3.050 14.789 5.943 1.00 0.00 O ATOM 0 H SER A 722 2.479 11.534 6.658 1.00 0.00 H new ATOM 0 HA SER A 722 1.603 12.786 5.090 1.00 0.00 H new ATOM 0 HB2 SER A 722 4.433 13.837 4.743 1.00 0.00 H new ATOM 0 HB3 SER A 722 3.047 14.499 3.900 1.00 0.00 H new ATOM 0 HG SER A 722 3.511 15.651 5.865 1.00 0.00 H new ATOM 476 N PHE A 723 3.243 10.710 3.585 1.00 0.00 N ATOM 477 CA PHE A 723 3.435 9.912 2.447 1.00 0.00 C ATOM 478 C PHE A 723 2.918 8.523 2.726 1.00 0.00 C ATOM 479 O PHE A 723 2.970 8.033 3.855 1.00 0.00 O ATOM 480 CB PHE A 723 4.913 9.852 2.043 1.00 0.00 C ATOM 481 CG PHE A 723 5.508 11.164 1.603 1.00 0.00 C ATOM 482 CD1 PHE A 723 5.386 11.580 0.302 1.00 0.00 C ATOM 483 CD2 PHE A 723 6.206 11.963 2.486 1.00 0.00 C ATOM 484 CE1 PHE A 723 5.943 12.768 -0.118 1.00 0.00 C ATOM 485 CE2 PHE A 723 6.762 13.153 2.078 1.00 0.00 C ATOM 486 CZ PHE A 723 6.631 13.554 0.772 1.00 0.00 C ATOM 0 H PHE A 723 3.526 10.254 4.452 1.00 0.00 H new ATOM 0 HA PHE A 723 2.886 10.356 1.616 1.00 0.00 H new ATOM 0 HB2 PHE A 723 5.490 9.474 2.887 1.00 0.00 H new ATOM 0 HB3 PHE A 723 5.023 9.131 1.233 1.00 0.00 H new ATOM 0 HD1 PHE A 723 4.845 10.967 -0.404 1.00 0.00 H new ATOM 0 HD2 PHE A 723 6.317 11.649 3.513 1.00 0.00 H new ATOM 0 HE1 PHE A 723 5.838 13.080 -1.147 1.00 0.00 H new ATOM 0 HE2 PHE A 723 7.300 13.770 2.783 1.00 0.00 H new ATOM 0 HZ PHE A 723 7.068 14.486 0.445 1.00 0.00 H new ATOM 496 N THR A 724 2.438 7.942 1.711 1.00 0.00 N ATOM 497 CA THR A 724 1.865 6.638 1.697 1.00 0.00 C ATOM 498 C THR A 724 2.736 5.675 0.861 1.00 0.00 C ATOM 499 O THR A 724 3.237 6.049 -0.212 1.00 0.00 O ATOM 500 CB THR A 724 0.387 6.697 1.161 1.00 0.00 C ATOM 501 OG1 THR A 724 -0.539 6.847 2.234 1.00 0.00 O ATOM 502 CG2 THR A 724 0.048 5.490 0.353 1.00 0.00 C ATOM 0 H THR A 724 2.426 8.384 0.792 1.00 0.00 H new ATOM 0 HA THR A 724 1.834 6.253 2.716 1.00 0.00 H new ATOM 0 HB THR A 724 0.314 7.569 0.512 1.00 0.00 H new ATOM 0 HG1 THR A 724 -0.573 6.018 2.755 1.00 0.00 H new ATOM 0 HG21 THR A 724 -0.980 5.566 -0.000 1.00 0.00 H new ATOM 0 HG22 THR A 724 0.721 5.423 -0.502 1.00 0.00 H new ATOM 0 HG23 THR A 724 0.155 4.598 0.970 1.00 0.00 H new ATOM 510 N MET A 725 2.904 4.463 1.380 1.00 0.00 N ATOM 511 CA MET A 725 3.678 3.411 0.771 1.00 0.00 C ATOM 512 C MET A 725 2.810 2.645 -0.187 1.00 0.00 C ATOM 513 O MET A 725 1.764 2.117 0.182 1.00 0.00 O ATOM 514 CB MET A 725 4.176 2.430 1.835 1.00 0.00 C ATOM 515 CG MET A 725 4.948 1.244 1.273 1.00 0.00 C ATOM 516 SD MET A 725 4.558 -0.309 2.123 1.00 0.00 S ATOM 517 CE MET A 725 2.814 -0.472 1.722 1.00 0.00 C ATOM 0 H MET A 725 2.486 4.186 2.268 1.00 0.00 H new ATOM 0 HA MET A 725 4.525 3.863 0.255 1.00 0.00 H new ATOM 0 HB2 MET A 725 4.814 2.966 2.538 1.00 0.00 H new ATOM 0 HB3 MET A 725 3.321 2.059 2.400 1.00 0.00 H new ATOM 0 HG2 MET A 725 4.723 1.139 0.212 1.00 0.00 H new ATOM 0 HG3 MET A 725 6.017 1.440 1.355 1.00 0.00 H new ATOM 0 HE1 MET A 725 2.502 -1.506 1.868 1.00 0.00 H new ATOM 0 HE2 MET A 725 2.229 0.179 2.372 1.00 0.00 H new ATOM 0 HE3 MET A 725 2.652 -0.187 0.682 1.00 0.00 H new ATOM 527 N ILE A 726 3.220 2.611 -1.386 1.00 0.00 N ATOM 528 CA ILE A 726 2.542 1.861 -2.402 1.00 0.00 C ATOM 529 C ILE A 726 3.360 0.675 -2.879 1.00 0.00 C ATOM 530 O ILE A 726 4.555 0.799 -3.203 1.00 0.00 O ATOM 531 CB ILE A 726 2.089 2.762 -3.588 1.00 0.00 C ATOM 532 CG1 ILE A 726 1.047 3.753 -3.086 1.00 0.00 C ATOM 533 CG2 ILE A 726 1.535 1.943 -4.765 1.00 0.00 C ATOM 534 CD1 ILE A 726 -0.128 3.077 -2.399 1.00 0.00 C ATOM 0 H ILE A 726 4.049 3.106 -1.715 1.00 0.00 H new ATOM 0 HA ILE A 726 1.639 1.460 -1.942 1.00 0.00 H new ATOM 0 HB ILE A 726 2.961 3.296 -3.965 1.00 0.00 H new ATOM 0 HG12 ILE A 726 1.518 4.447 -2.390 1.00 0.00 H new ATOM 0 HG13 ILE A 726 0.680 4.343 -3.926 1.00 0.00 H new ATOM 0 HG21 ILE A 726 1.233 2.617 -5.567 1.00 0.00 H new ATOM 0 HG22 ILE A 726 2.306 1.266 -5.132 1.00 0.00 H new ATOM 0 HG23 ILE A 726 0.673 1.365 -4.432 1.00 0.00 H new ATOM 0 HD11 ILE A 726 -0.837 3.833 -2.063 1.00 0.00 H new ATOM 0 HD12 ILE A 726 -0.621 2.403 -3.100 1.00 0.00 H new ATOM 0 HD13 ILE A 726 0.230 2.509 -1.541 1.00 0.00 H new ATOM 546 N GLY A 727 2.727 -0.476 -2.846 1.00 0.00 N ATOM 547 CA GLY A 727 3.297 -1.683 -3.355 1.00 0.00 C ATOM 548 C GLY A 727 3.875 -2.526 -2.283 1.00 0.00 C ATOM 549 O GLY A 727 3.228 -3.432 -1.761 1.00 0.00 O ATOM 0 H GLY A 727 1.791 -0.592 -2.458 1.00 0.00 H new ATOM 0 HA2 GLY A 727 2.531 -2.248 -3.886 1.00 0.00 H new ATOM 0 HA3 GLY A 727 4.073 -1.438 -4.080 1.00 0.00 H new ATOM 553 N HIS A 728 5.064 -2.199 -1.926 1.00 0.00 N ATOM 554 CA HIS A 728 5.836 -2.918 -1.024 1.00 0.00 C ATOM 555 C HIS A 728 6.675 -1.925 -0.286 1.00 0.00 C ATOM 556 O HIS A 728 6.627 -0.759 -0.623 1.00 0.00 O ATOM 557 CB HIS A 728 6.708 -3.876 -1.796 1.00 0.00 C ATOM 558 CG HIS A 728 7.602 -3.256 -2.844 1.00 0.00 C ATOM 559 ND1 HIS A 728 7.229 -3.111 -4.147 1.00 0.00 N ATOM 560 CD2 HIS A 728 8.851 -2.746 -2.752 1.00 0.00 C ATOM 561 CE1 HIS A 728 8.189 -2.542 -4.819 1.00 0.00 C ATOM 562 NE2 HIS A 728 9.195 -2.307 -4.001 1.00 0.00 N ATOM 0 H HIS A 728 5.537 -1.370 -2.287 1.00 0.00 H new ATOM 0 HA HIS A 728 5.226 -3.490 -0.325 1.00 0.00 H new ATOM 0 HB2 HIS A 728 7.334 -4.419 -1.088 1.00 0.00 H new ATOM 0 HB3 HIS A 728 6.066 -4.610 -2.282 1.00 0.00 H new ATOM 0 HD2 HIS A 728 9.461 -2.695 -1.862 1.00 0.00 H new ATOM 0 HE1 HIS A 728 8.164 -2.303 -5.872 1.00 0.00 H new ATOM 0 HE2 HIS A 728 10.081 -1.871 -4.256 1.00 0.00 H new ATOM 571 N ARG A 729 7.466 -2.368 0.656 1.00 0.00 N ATOM 572 CA ARG A 729 8.260 -1.440 1.441 1.00 0.00 C ATOM 573 C ARG A 729 9.725 -1.835 1.461 1.00 0.00 C ATOM 574 O ARG A 729 10.507 -1.248 2.156 1.00 0.00 O ATOM 575 CB ARG A 729 7.745 -1.383 2.893 1.00 0.00 C ATOM 576 CG ARG A 729 8.195 -2.530 3.834 1.00 0.00 C ATOM 577 CD ARG A 729 7.737 -3.928 3.425 1.00 0.00 C ATOM 578 NE ARG A 729 8.074 -4.917 4.466 1.00 0.00 N ATOM 579 CZ ARG A 729 8.486 -6.181 4.277 1.00 0.00 C ATOM 580 NH1 ARG A 729 8.821 -6.626 3.072 1.00 0.00 N ATOM 581 NH2 ARG A 729 8.626 -6.968 5.325 1.00 0.00 N ATOM 0 H ARG A 729 7.582 -3.351 0.902 1.00 0.00 H new ATOM 0 HA ARG A 729 8.164 -0.461 0.971 1.00 0.00 H new ATOM 0 HB2 ARG A 729 8.065 -0.438 3.331 1.00 0.00 H new ATOM 0 HB3 ARG A 729 6.655 -1.370 2.868 1.00 0.00 H new ATOM 0 HG2 ARG A 729 9.283 -2.525 3.891 1.00 0.00 H new ATOM 0 HG3 ARG A 729 7.822 -2.322 4.837 1.00 0.00 H new ATOM 0 HD2 ARG A 729 6.661 -3.927 3.253 1.00 0.00 H new ATOM 0 HD3 ARG A 729 8.209 -4.209 2.484 1.00 0.00 H new ATOM 0 HE ARG A 729 7.984 -4.607 5.434 1.00 0.00 H new ATOM 0 HH11 ARG A 729 8.768 -6.004 2.266 1.00 0.00 H new ATOM 0 HH12 ARG A 729 9.131 -7.590 2.953 1.00 0.00 H new ATOM 0 HH21 ARG A 729 8.422 -6.614 6.260 1.00 0.00 H new ATOM 0 HH22 ARG A 729 8.938 -7.931 5.201 1.00 0.00 H new ATOM 595 N SER A 730 10.096 -2.811 0.718 1.00 0.00 N ATOM 596 CA SER A 730 11.417 -3.309 0.844 1.00 0.00 C ATOM 597 C SER A 730 12.165 -3.359 -0.445 1.00 0.00 C ATOM 598 O SER A 730 11.591 -3.287 -1.533 1.00 0.00 O ATOM 599 CB SER A 730 11.348 -4.658 1.520 1.00 0.00 C ATOM 600 OG SER A 730 10.223 -5.393 1.026 1.00 0.00 O ATOM 0 H SER A 730 9.513 -3.278 0.023 1.00 0.00 H new ATOM 0 HA SER A 730 11.992 -2.614 1.455 1.00 0.00 H new ATOM 0 HB2 SER A 730 12.267 -5.215 1.335 1.00 0.00 H new ATOM 0 HB3 SER A 730 11.264 -4.530 2.599 1.00 0.00 H new ATOM 0 HG SER A 730 10.419 -6.353 1.059 1.00 0.00 H new ATOM 606 N ILE A 731 13.448 -3.413 -0.303 1.00 0.00 N ATOM 607 CA ILE A 731 14.346 -3.543 -1.399 1.00 0.00 C ATOM 608 C ILE A 731 15.121 -4.808 -1.217 1.00 0.00 C ATOM 609 O ILE A 731 15.210 -5.308 -0.105 1.00 0.00 O ATOM 610 CB ILE A 731 15.329 -2.371 -1.498 1.00 0.00 C ATOM 611 CG1 ILE A 731 16.160 -2.251 -0.227 1.00 0.00 C ATOM 612 CG2 ILE A 731 14.583 -1.090 -1.761 1.00 0.00 C ATOM 613 CD1 ILE A 731 17.191 -1.173 -0.292 1.00 0.00 C ATOM 0 H ILE A 731 13.912 -3.367 0.604 1.00 0.00 H new ATOM 0 HA ILE A 731 13.759 -3.554 -2.317 1.00 0.00 H new ATOM 0 HB ILE A 731 16.008 -2.560 -2.330 1.00 0.00 H new ATOM 0 HG12 ILE A 731 15.496 -2.058 0.616 1.00 0.00 H new ATOM 0 HG13 ILE A 731 16.653 -3.204 -0.033 1.00 0.00 H new ATOM 0 HG21 ILE A 731 15.291 -0.264 -1.829 1.00 0.00 H new ATOM 0 HG22 ILE A 731 14.033 -1.175 -2.698 1.00 0.00 H new ATOM 0 HG23 ILE A 731 13.884 -0.902 -0.946 1.00 0.00 H new ATOM 0 HD11 ILE A 731 17.746 -1.143 0.646 1.00 0.00 H new ATOM 0 HD12 ILE A 731 17.878 -1.375 -1.114 1.00 0.00 H new ATOM 0 HD13 ILE A 731 16.703 -0.212 -0.455 1.00 0.00 H new ATOM 625 N THR A 732 15.678 -5.313 -2.268 1.00 0.00 N ATOM 626 CA THR A 732 16.412 -6.562 -2.184 1.00 0.00 C ATOM 627 C THR A 732 17.738 -6.462 -2.931 1.00 0.00 C ATOM 628 O THR A 732 17.799 -5.906 -4.008 1.00 0.00 O ATOM 629 CB THR A 732 15.570 -7.715 -2.778 1.00 0.00 C ATOM 630 OG1 THR A 732 14.224 -7.662 -2.230 1.00 0.00 O ATOM 631 CG2 THR A 732 16.185 -9.070 -2.442 1.00 0.00 C ATOM 0 H THR A 732 15.647 -4.893 -3.197 1.00 0.00 H new ATOM 0 HA THR A 732 16.616 -6.766 -1.133 1.00 0.00 H new ATOM 0 HB THR A 732 15.546 -7.598 -3.861 1.00 0.00 H new ATOM 0 HG1 THR A 732 13.689 -8.391 -2.607 1.00 0.00 H new ATOM 0 HG21 THR A 732 15.574 -9.864 -2.871 1.00 0.00 H new ATOM 0 HG22 THR A 732 17.192 -9.125 -2.854 1.00 0.00 H new ATOM 0 HG23 THR A 732 16.229 -9.191 -1.360 1.00 0.00 H new ATOM 639 N CYS A 733 18.788 -6.948 -2.321 1.00 0.00 N ATOM 640 CA CYS A 733 20.090 -6.976 -2.943 1.00 0.00 C ATOM 641 C CYS A 733 20.235 -8.229 -3.783 1.00 0.00 C ATOM 642 O CYS A 733 20.381 -9.347 -3.253 1.00 0.00 O ATOM 643 CB CYS A 733 21.203 -6.853 -1.889 1.00 0.00 C ATOM 644 SG CYS A 733 22.899 -7.258 -2.463 1.00 0.00 S ATOM 0 H CYS A 733 18.766 -7.336 -1.378 1.00 0.00 H new ATOM 0 HA CYS A 733 20.188 -6.117 -3.607 1.00 0.00 H new ATOM 0 HB2 CYS A 733 21.204 -5.832 -1.507 1.00 0.00 H new ATOM 0 HB3 CYS A 733 20.958 -7.507 -1.052 1.00 0.00 H new ATOM 649 N ILE A 734 20.132 -8.040 -5.078 1.00 0.00 N ATOM 650 CA ILE A 734 20.208 -9.087 -6.069 1.00 0.00 C ATOM 651 C ILE A 734 20.898 -8.571 -7.319 1.00 0.00 C ATOM 652 O ILE A 734 20.831 -7.393 -7.612 1.00 0.00 O ATOM 653 CB ILE A 734 18.802 -9.714 -6.409 1.00 0.00 C ATOM 654 CG1 ILE A 734 17.649 -8.669 -6.408 1.00 0.00 C ATOM 655 CG2 ILE A 734 18.471 -10.873 -5.481 1.00 0.00 C ATOM 656 CD1 ILE A 734 17.721 -7.605 -7.481 1.00 0.00 C ATOM 0 H ILE A 734 19.987 -7.116 -5.485 1.00 0.00 H new ATOM 0 HA ILE A 734 20.801 -9.895 -5.642 1.00 0.00 H new ATOM 0 HB ILE A 734 18.884 -10.093 -7.428 1.00 0.00 H new ATOM 0 HG12 ILE A 734 16.703 -9.200 -6.513 1.00 0.00 H new ATOM 0 HG13 ILE A 734 17.632 -8.177 -5.436 1.00 0.00 H new ATOM 0 HG21 ILE A 734 17.495 -11.282 -5.743 1.00 0.00 H new ATOM 0 HG22 ILE A 734 19.229 -11.649 -5.584 1.00 0.00 H new ATOM 0 HG23 ILE A 734 18.451 -10.519 -4.450 1.00 0.00 H new ATOM 0 HD11 ILE A 734 16.868 -6.933 -7.385 1.00 0.00 H new ATOM 0 HD12 ILE A 734 18.645 -7.037 -7.369 1.00 0.00 H new ATOM 0 HD13 ILE A 734 17.702 -8.077 -8.463 1.00 0.00 H new ATOM 668 N HIS A 735 21.621 -9.437 -8.005 1.00 0.00 N ATOM 669 CA HIS A 735 22.358 -9.089 -9.243 1.00 0.00 C ATOM 670 C HIS A 735 23.485 -8.084 -9.020 1.00 0.00 C ATOM 671 O HIS A 735 24.140 -7.668 -9.961 1.00 0.00 O ATOM 672 CB HIS A 735 21.423 -8.599 -10.355 1.00 0.00 C ATOM 673 CG HIS A 735 20.656 -9.684 -11.027 1.00 0.00 C ATOM 674 ND1 HIS A 735 20.962 -10.134 -12.287 1.00 0.00 N ATOM 675 CD2 HIS A 735 19.585 -10.403 -10.622 1.00 0.00 C ATOM 676 CE1 HIS A 735 20.119 -11.082 -12.630 1.00 0.00 C ATOM 677 NE2 HIS A 735 19.272 -11.263 -11.635 1.00 0.00 N ATOM 0 H HIS A 735 21.725 -10.414 -7.731 1.00 0.00 H new ATOM 0 HA HIS A 735 22.821 -10.022 -9.564 1.00 0.00 H new ATOM 0 HB2 HIS A 735 20.721 -7.880 -9.934 1.00 0.00 H new ATOM 0 HB3 HIS A 735 22.012 -8.069 -11.103 1.00 0.00 H new ATOM 0 HD2 HIS A 735 19.073 -10.314 -9.675 1.00 0.00 H new ATOM 0 HE1 HIS A 735 20.120 -11.621 -13.566 1.00 0.00 H new ATOM 0 HE2 HIS A 735 18.506 -11.937 -11.624 1.00 0.00 H new ATOM 686 N GLY A 736 23.712 -7.726 -7.785 1.00 0.00 N ATOM 687 CA GLY A 736 24.751 -6.795 -7.459 1.00 0.00 C ATOM 688 C GLY A 736 24.232 -5.401 -7.310 1.00 0.00 C ATOM 689 O GLY A 736 24.971 -4.442 -7.504 1.00 0.00 O ATOM 0 H GLY A 736 23.184 -8.070 -6.983 1.00 0.00 H new ATOM 0 HA2 GLY A 736 25.234 -7.102 -6.532 1.00 0.00 H new ATOM 0 HA3 GLY A 736 25.513 -6.816 -8.238 1.00 0.00 H new ATOM 693 N VAL A 737 22.972 -5.275 -6.991 1.00 0.00 N ATOM 694 CA VAL A 737 22.352 -4.005 -6.810 1.00 0.00 C ATOM 695 C VAL A 737 21.080 -4.237 -6.008 1.00 0.00 C ATOM 696 O VAL A 737 20.640 -5.376 -5.854 1.00 0.00 O ATOM 697 CB VAL A 737 22.026 -3.345 -8.202 1.00 0.00 C ATOM 698 CG1 VAL A 737 20.975 -4.130 -8.982 1.00 0.00 C ATOM 699 CG2 VAL A 737 21.642 -1.871 -8.070 1.00 0.00 C ATOM 0 H VAL A 737 22.345 -6.067 -6.849 1.00 0.00 H new ATOM 0 HA VAL A 737 23.017 -3.322 -6.281 1.00 0.00 H new ATOM 0 HB VAL A 737 22.949 -3.384 -8.780 1.00 0.00 H new ATOM 0 HG11 VAL A 737 20.784 -3.636 -9.934 1.00 0.00 H new ATOM 0 HG12 VAL A 737 21.338 -5.142 -9.165 1.00 0.00 H new ATOM 0 HG13 VAL A 737 20.051 -4.174 -8.405 1.00 0.00 H new ATOM 0 HG21 VAL A 737 21.427 -1.461 -9.057 1.00 0.00 H new ATOM 0 HG22 VAL A 737 20.758 -1.780 -7.439 1.00 0.00 H new ATOM 0 HG23 VAL A 737 22.467 -1.319 -7.620 1.00 0.00 H new ATOM 709 N TRP A 738 20.559 -3.217 -5.439 1.00 0.00 N ATOM 710 CA TRP A 738 19.284 -3.308 -4.784 1.00 0.00 C ATOM 711 C TRP A 738 18.173 -3.230 -5.817 1.00 0.00 C ATOM 712 O TRP A 738 18.420 -2.968 -7.001 1.00 0.00 O ATOM 713 CB TRP A 738 19.124 -2.210 -3.756 1.00 0.00 C ATOM 714 CG TRP A 738 20.102 -2.284 -2.652 1.00 0.00 C ATOM 715 CD1 TRP A 738 21.269 -1.606 -2.564 1.00 0.00 C ATOM 716 CD2 TRP A 738 20.003 -3.069 -1.477 1.00 0.00 C ATOM 717 NE1 TRP A 738 21.910 -1.912 -1.411 1.00 0.00 N ATOM 718 CE2 TRP A 738 21.150 -2.818 -0.721 1.00 0.00 C ATOM 719 CE3 TRP A 738 19.051 -3.965 -0.989 1.00 0.00 C ATOM 720 CZ2 TRP A 738 21.370 -3.420 0.488 1.00 0.00 C ATOM 721 CZ3 TRP A 738 19.269 -4.567 0.224 1.00 0.00 C ATOM 722 CH2 TRP A 738 20.429 -4.288 0.951 1.00 0.00 C ATOM 0 H TRP A 738 20.991 -2.294 -5.406 1.00 0.00 H new ATOM 0 HA TRP A 738 19.226 -4.265 -4.265 1.00 0.00 H new ATOM 0 HB2 TRP A 738 19.221 -1.244 -4.251 1.00 0.00 H new ATOM 0 HB3 TRP A 738 18.117 -2.256 -3.341 1.00 0.00 H new ATOM 0 HD1 TRP A 738 21.638 -0.917 -3.309 1.00 0.00 H new ATOM 0 HE1 TRP A 738 22.807 -1.532 -1.108 1.00 0.00 H new ATOM 0 HE3 TRP A 738 18.158 -4.181 -1.557 1.00 0.00 H new ATOM 0 HZ2 TRP A 738 22.264 -3.213 1.058 1.00 0.00 H new ATOM 0 HZ3 TRP A 738 18.541 -5.260 0.619 1.00 0.00 H new ATOM 0 HH2 TRP A 738 20.583 -4.773 1.904 1.00 0.00 H new ATOM 733 N THR A 739 16.973 -3.439 -5.379 1.00 0.00 N ATOM 734 CA THR A 739 15.844 -3.440 -6.240 1.00 0.00 C ATOM 735 C THR A 739 15.380 -2.018 -6.601 1.00 0.00 C ATOM 736 O THR A 739 16.095 -1.031 -6.407 1.00 0.00 O ATOM 737 CB THR A 739 14.716 -4.306 -5.639 1.00 0.00 C ATOM 738 OG1 THR A 739 14.487 -3.947 -4.297 1.00 0.00 O ATOM 739 CG2 THR A 739 15.067 -5.780 -5.731 1.00 0.00 C ATOM 0 H THR A 739 16.751 -3.616 -4.399 1.00 0.00 H new ATOM 0 HA THR A 739 16.139 -3.893 -7.187 1.00 0.00 H new ATOM 0 HB THR A 739 13.806 -4.129 -6.212 1.00 0.00 H new ATOM 0 HG1 THR A 739 14.543 -2.973 -4.205 1.00 0.00 H new ATOM 0 HG21 THR A 739 14.260 -6.374 -5.302 1.00 0.00 H new ATOM 0 HG22 THR A 739 15.205 -6.057 -6.776 1.00 0.00 H new ATOM 0 HG23 THR A 739 15.989 -5.970 -5.181 1.00 0.00 H new ATOM 747 N GLN A 740 14.190 -1.942 -7.068 1.00 0.00 N ATOM 748 CA GLN A 740 13.635 -0.768 -7.710 1.00 0.00 C ATOM 749 C GLN A 740 13.055 0.245 -6.731 1.00 0.00 C ATOM 750 O GLN A 740 12.520 1.266 -7.162 1.00 0.00 O ATOM 751 CB GLN A 740 12.547 -1.194 -8.721 1.00 0.00 C ATOM 752 CG GLN A 740 11.258 -1.746 -8.089 1.00 0.00 C ATOM 753 CD GLN A 740 11.393 -3.064 -7.323 1.00 0.00 C ATOM 754 OE1 GLN A 740 10.694 -3.286 -6.349 1.00 0.00 O ATOM 755 NE2 GLN A 740 12.255 -3.943 -7.747 1.00 0.00 N ATOM 0 H GLN A 740 13.532 -2.720 -7.021 1.00 0.00 H new ATOM 0 HA GLN A 740 14.462 -0.272 -8.218 1.00 0.00 H new ATOM 0 HB2 GLN A 740 12.291 -0.335 -9.341 1.00 0.00 H new ATOM 0 HB3 GLN A 740 12.964 -1.953 -9.383 1.00 0.00 H new ATOM 0 HG2 GLN A 740 10.860 -0.993 -7.408 1.00 0.00 H new ATOM 0 HG3 GLN A 740 10.520 -1.883 -8.879 1.00 0.00 H new ATOM 0 HE21 GLN A 740 12.831 -3.739 -8.564 1.00 0.00 H new ATOM 0 HE22 GLN A 740 12.354 -4.835 -7.262 1.00 0.00 H new ATOM 764 N LEU A 741 13.163 -0.044 -5.424 1.00 0.00 N ATOM 765 CA LEU A 741 12.615 0.831 -4.359 1.00 0.00 C ATOM 766 C LEU A 741 11.072 0.785 -4.325 1.00 0.00 C ATOM 767 O LEU A 741 10.424 0.375 -5.299 1.00 0.00 O ATOM 768 CB LEU A 741 13.111 2.321 -4.479 1.00 0.00 C ATOM 769 CG LEU A 741 14.547 2.671 -4.017 1.00 0.00 C ATOM 770 CD1 LEU A 741 14.726 2.407 -2.536 1.00 0.00 C ATOM 771 CD2 LEU A 741 15.613 1.951 -4.834 1.00 0.00 C ATOM 0 H LEU A 741 13.627 -0.881 -5.072 1.00 0.00 H new ATOM 0 HA LEU A 741 12.998 0.434 -3.419 1.00 0.00 H new ATOM 0 HB2 LEU A 741 13.020 2.615 -5.525 1.00 0.00 H new ATOM 0 HB3 LEU A 741 12.421 2.945 -3.911 1.00 0.00 H new ATOM 0 HG LEU A 741 14.681 3.738 -4.192 1.00 0.00 H new ATOM 0 HD11 LEU A 741 15.744 2.662 -2.241 1.00 0.00 H new ATOM 0 HD12 LEU A 741 14.021 3.016 -1.970 1.00 0.00 H new ATOM 0 HD13 LEU A 741 14.542 1.353 -2.330 1.00 0.00 H new ATOM 0 HD21 LEU A 741 16.601 2.231 -4.470 1.00 0.00 H new ATOM 0 HD22 LEU A 741 15.481 0.874 -4.735 1.00 0.00 H new ATOM 0 HD23 LEU A 741 15.520 2.233 -5.883 1.00 0.00 H new ATOM 783 N PRO A 742 10.469 1.095 -3.176 1.00 0.00 N ATOM 784 CA PRO A 742 9.026 1.225 -3.069 1.00 0.00 C ATOM 785 C PRO A 742 8.532 2.590 -3.578 1.00 0.00 C ATOM 786 O PRO A 742 9.314 3.390 -4.107 1.00 0.00 O ATOM 787 CB PRO A 742 8.757 1.082 -1.583 1.00 0.00 C ATOM 788 CG PRO A 742 10.018 1.450 -0.898 1.00 0.00 C ATOM 789 CD PRO A 742 11.140 1.293 -1.880 1.00 0.00 C ATOM 0 HA PRO A 742 8.505 0.484 -3.675 1.00 0.00 H new ATOM 0 HB2 PRO A 742 7.940 1.733 -1.271 1.00 0.00 H new ATOM 0 HB3 PRO A 742 8.464 0.061 -1.337 1.00 0.00 H new ATOM 0 HG2 PRO A 742 9.969 2.477 -0.536 1.00 0.00 H new ATOM 0 HG3 PRO A 742 10.180 0.812 -0.029 1.00 0.00 H new ATOM 0 HD2 PRO A 742 11.781 2.175 -1.895 1.00 0.00 H new ATOM 0 HD3 PRO A 742 11.773 0.443 -1.627 1.00 0.00 H new ATOM 797 N GLN A 743 7.260 2.861 -3.406 1.00 0.00 N ATOM 798 CA GLN A 743 6.681 4.085 -3.906 1.00 0.00 C ATOM 799 C GLN A 743 6.028 4.867 -2.776 1.00 0.00 C ATOM 800 O GLN A 743 4.988 4.468 -2.274 1.00 0.00 O ATOM 801 CB GLN A 743 5.630 3.754 -4.982 1.00 0.00 C ATOM 802 CG GLN A 743 5.007 4.965 -5.673 1.00 0.00 C ATOM 803 CD GLN A 743 3.904 4.578 -6.646 1.00 0.00 C ATOM 804 OE1 GLN A 743 2.968 5.458 -6.862 1.00 0.00 O flip ATOM 805 NE2 GLN A 743 3.912 3.487 -7.223 1.00 0.00 N flip ATOM 0 H GLN A 743 6.604 2.248 -2.922 1.00 0.00 H new ATOM 0 HA GLN A 743 7.472 4.696 -4.341 1.00 0.00 H new ATOM 0 HB2 GLN A 743 6.094 3.122 -5.739 1.00 0.00 H new ATOM 0 HB3 GLN A 743 4.834 3.168 -4.522 1.00 0.00 H new ATOM 0 HG2 GLN A 743 4.602 5.640 -4.919 1.00 0.00 H new ATOM 0 HG3 GLN A 743 5.783 5.513 -6.208 1.00 0.00 H new ATOM 0 HE21 GLN A 743 4.657 2.816 -7.035 1.00 0.00 H new ATOM 0 HE22 GLN A 743 3.174 3.256 -7.888 1.00 0.00 H new ATOM 814 N CYS A 744 6.667 5.919 -2.336 1.00 0.00 N ATOM 815 CA CYS A 744 6.049 6.811 -1.367 1.00 0.00 C ATOM 816 C CYS A 744 5.429 7.994 -2.052 1.00 0.00 C ATOM 817 O CYS A 744 6.119 8.806 -2.667 1.00 0.00 O ATOM 818 CB CYS A 744 7.024 7.283 -0.297 1.00 0.00 C ATOM 819 SG CYS A 744 7.520 5.998 0.870 1.00 0.00 S ATOM 0 H CYS A 744 7.608 6.185 -2.625 1.00 0.00 H new ATOM 0 HA CYS A 744 5.272 6.233 -0.867 1.00 0.00 H new ATOM 0 HB2 CYS A 744 7.915 7.680 -0.783 1.00 0.00 H new ATOM 0 HB3 CYS A 744 6.569 8.105 0.256 1.00 0.00 H new ATOM 824 N VAL A 745 4.137 8.080 -1.978 1.00 0.00 N ATOM 825 CA VAL A 745 3.430 9.178 -2.545 1.00 0.00 C ATOM 826 C VAL A 745 2.920 10.041 -1.440 1.00 0.00 C ATOM 827 O VAL A 745 2.554 9.555 -0.403 1.00 0.00 O ATOM 828 CB VAL A 745 2.273 8.738 -3.469 1.00 0.00 C ATOM 829 CG1 VAL A 745 1.541 9.937 -4.082 1.00 0.00 C ATOM 830 CG2 VAL A 745 2.770 7.812 -4.555 1.00 0.00 C ATOM 0 H VAL A 745 3.544 7.387 -1.521 1.00 0.00 H new ATOM 0 HA VAL A 745 4.123 9.735 -3.176 1.00 0.00 H new ATOM 0 HB VAL A 745 1.558 8.197 -2.849 1.00 0.00 H new ATOM 0 HG11 VAL A 745 0.735 9.582 -4.725 1.00 0.00 H new ATOM 0 HG12 VAL A 745 1.125 10.555 -3.286 1.00 0.00 H new ATOM 0 HG13 VAL A 745 2.241 10.528 -4.672 1.00 0.00 H new ATOM 0 HG21 VAL A 745 1.936 7.517 -5.192 1.00 0.00 H new ATOM 0 HG22 VAL A 745 3.521 8.326 -5.156 1.00 0.00 H new ATOM 0 HG23 VAL A 745 3.212 6.925 -4.102 1.00 0.00 H new ATOM 840 N ALA A 746 2.873 11.315 -1.705 1.00 0.00 N ATOM 841 CA ALA A 746 2.499 12.385 -0.749 1.00 0.00 C ATOM 842 C ALA A 746 1.070 12.314 -0.269 1.00 0.00 C ATOM 843 O ALA A 746 0.599 13.213 0.410 1.00 0.00 O ATOM 844 CB ALA A 746 2.733 13.721 -1.377 1.00 0.00 C ATOM 0 H ALA A 746 3.100 11.681 -2.630 1.00 0.00 H new ATOM 0 HA ALA A 746 3.130 12.238 0.127 1.00 0.00 H new ATOM 0 HB1 ALA A 746 2.458 14.507 -0.674 1.00 0.00 H new ATOM 0 HB2 ALA A 746 3.786 13.821 -1.638 1.00 0.00 H new ATOM 0 HB3 ALA A 746 2.126 13.811 -2.278 1.00 0.00 H new ATOM 850 N ILE A 747 0.380 11.302 -0.715 1.00 0.00 N ATOM 851 CA ILE A 747 -0.995 10.963 -0.315 1.00 0.00 C ATOM 852 C ILE A 747 -2.019 11.856 -1.014 1.00 0.00 C ATOM 853 O ILE A 747 -3.131 11.454 -1.329 1.00 0.00 O ATOM 854 CB ILE A 747 -1.095 11.052 1.222 1.00 0.00 C ATOM 855 CG1 ILE A 747 -0.444 9.871 1.917 1.00 0.00 C ATOM 856 CG2 ILE A 747 -2.479 11.369 1.768 1.00 0.00 C ATOM 857 CD1 ILE A 747 -0.458 9.946 3.435 1.00 0.00 C ATOM 0 H ILE A 747 0.761 10.649 -1.400 1.00 0.00 H new ATOM 0 HA ILE A 747 -1.228 9.945 -0.627 1.00 0.00 H new ATOM 0 HB ILE A 747 -0.509 11.936 1.474 1.00 0.00 H new ATOM 0 HG12 ILE A 747 -0.952 8.958 1.606 1.00 0.00 H new ATOM 0 HG13 ILE A 747 0.589 9.792 1.579 1.00 0.00 H new ATOM 0 HG21 ILE A 747 -2.440 11.409 2.857 1.00 0.00 H new ATOM 0 HG22 ILE A 747 -2.811 12.333 1.381 1.00 0.00 H new ATOM 0 HG23 ILE A 747 -3.179 10.593 1.458 1.00 0.00 H new ATOM 0 HD11 ILE A 747 0.028 9.062 3.847 1.00 0.00 H new ATOM 0 HD12 ILE A 747 0.077 10.838 3.760 1.00 0.00 H new ATOM 0 HD13 ILE A 747 -1.488 9.992 3.788 1.00 0.00 H new ATOM 869 N ASP A 748 -1.538 12.960 -1.378 1.00 0.00 N ATOM 870 CA ASP A 748 -2.289 14.066 -1.922 1.00 0.00 C ATOM 871 C ASP A 748 -2.536 13.826 -3.375 1.00 0.00 C ATOM 872 O ASP A 748 -3.485 14.314 -3.972 1.00 0.00 O ATOM 873 CB ASP A 748 -1.439 15.306 -1.741 1.00 0.00 C ATOM 874 CG ASP A 748 -2.106 16.580 -2.202 1.00 0.00 C ATOM 875 OD1 ASP A 748 -2.950 17.124 -1.453 1.00 0.00 O ATOM 876 OD2 ASP A 748 -1.762 17.101 -3.286 1.00 0.00 O ATOM 0 H ASP A 748 -0.540 13.161 -1.312 1.00 0.00 H new ATOM 0 HA ASP A 748 -3.251 14.179 -1.422 1.00 0.00 H new ATOM 0 HB2 ASP A 748 -1.179 15.405 -0.687 1.00 0.00 H new ATOM 0 HB3 ASP A 748 -0.506 15.178 -2.289 1.00 0.00 H new ATOM 881 N LYS A 749 -1.672 13.035 -3.924 1.00 0.00 N ATOM 882 CA LYS A 749 -1.706 12.685 -5.302 1.00 0.00 C ATOM 883 C LYS A 749 -1.968 11.207 -5.477 1.00 0.00 C ATOM 884 O LYS A 749 -1.660 10.616 -6.510 1.00 0.00 O ATOM 885 CB LYS A 749 -0.437 13.145 -5.985 1.00 0.00 C ATOM 886 CG LYS A 749 0.759 13.183 -5.075 1.00 0.00 C ATOM 887 CD LYS A 749 1.905 14.024 -5.644 1.00 0.00 C ATOM 888 CE LYS A 749 2.500 13.466 -6.937 1.00 0.00 C ATOM 889 NZ LYS A 749 3.129 12.149 -6.739 1.00 0.00 N ATOM 0 H LYS A 749 -0.903 12.604 -3.410 1.00 0.00 H new ATOM 0 HA LYS A 749 -2.536 13.200 -5.786 1.00 0.00 H new ATOM 0 HB2 LYS A 749 -0.224 12.481 -6.823 1.00 0.00 H new ATOM 0 HB3 LYS A 749 -0.598 14.140 -6.400 1.00 0.00 H new ATOM 0 HG2 LYS A 749 0.462 13.588 -4.107 1.00 0.00 H new ATOM 0 HG3 LYS A 749 1.111 12.166 -4.901 1.00 0.00 H new ATOM 0 HD2 LYS A 749 1.543 15.035 -5.829 1.00 0.00 H new ATOM 0 HD3 LYS A 749 2.694 14.099 -4.895 1.00 0.00 H new ATOM 0 HE2 LYS A 749 1.715 13.382 -7.689 1.00 0.00 H new ATOM 0 HE3 LYS A 749 3.240 14.165 -7.325 1.00 0.00 H new ATOM 0 HZ1 LYS A 749 3.717 11.918 -7.565 1.00 0.00 H new ATOM 0 HZ2 LYS A 749 3.723 12.173 -5.886 1.00 0.00 H new ATOM 0 HZ3 LYS A 749 2.391 11.425 -6.626 1.00 0.00 H new ATOM 903 N LEU A 750 -2.582 10.623 -4.461 1.00 0.00 N ATOM 904 CA LEU A 750 -2.985 9.269 -4.505 1.00 0.00 C ATOM 905 C LEU A 750 -4.304 9.184 -5.256 1.00 0.00 C ATOM 906 O LEU A 750 -4.787 10.173 -5.826 1.00 0.00 O ATOM 907 CB LEU A 750 -3.110 8.655 -3.083 1.00 0.00 C ATOM 908 CG LEU A 750 -1.852 8.515 -2.289 1.00 0.00 C ATOM 909 CD1 LEU A 750 -2.117 7.812 -1.022 1.00 0.00 C ATOM 910 CD2 LEU A 750 -0.852 7.793 -3.019 1.00 0.00 C ATOM 0 H LEU A 750 -2.806 11.098 -3.586 1.00 0.00 H new ATOM 0 HA LEU A 750 -2.224 8.687 -5.024 1.00 0.00 H new ATOM 0 HB2 LEU A 750 -3.805 9.268 -2.510 1.00 0.00 H new ATOM 0 HB3 LEU A 750 -3.561 7.667 -3.179 1.00 0.00 H new ATOM 0 HG LEU A 750 -1.485 9.521 -2.084 1.00 0.00 H new ATOM 0 HD11 LEU A 750 -1.190 7.719 -0.457 1.00 0.00 H new ATOM 0 HD12 LEU A 750 -2.843 8.377 -0.437 1.00 0.00 H new ATOM 0 HD13 LEU A 750 -2.514 6.819 -1.233 1.00 0.00 H new ATOM 0 HD21 LEU A 750 0.050 7.709 -2.414 1.00 0.00 H new ATOM 0 HD22 LEU A 750 -1.224 6.796 -3.257 1.00 0.00 H new ATOM 0 HD23 LEU A 750 -0.621 8.324 -3.942 1.00 0.00 H new ATOM 922 N LYS A 751 -4.915 8.070 -5.198 1.00 0.00 N ATOM 923 CA LYS A 751 -6.072 7.813 -5.935 1.00 0.00 C ATOM 924 C LYS A 751 -7.172 7.433 -5.000 1.00 0.00 C ATOM 925 O LYS A 751 -6.941 6.964 -3.871 1.00 0.00 O ATOM 926 CB LYS A 751 -5.843 6.680 -6.922 1.00 0.00 C ATOM 927 CG LYS A 751 -4.759 6.909 -7.960 1.00 0.00 C ATOM 928 CD LYS A 751 -4.611 5.692 -8.858 1.00 0.00 C ATOM 929 CE LYS A 751 -5.839 5.485 -9.737 1.00 0.00 C ATOM 930 NZ LYS A 751 -5.938 6.515 -10.793 1.00 0.00 N ATOM 0 H LYS A 751 -4.611 7.289 -4.616 1.00 0.00 H new ATOM 0 HA LYS A 751 -6.339 8.711 -6.491 1.00 0.00 H new ATOM 0 HB2 LYS A 751 -5.595 5.780 -6.360 1.00 0.00 H new ATOM 0 HB3 LYS A 751 -6.780 6.483 -7.442 1.00 0.00 H new ATOM 0 HG2 LYS A 751 -5.004 7.784 -8.562 1.00 0.00 H new ATOM 0 HG3 LYS A 751 -3.811 7.119 -7.464 1.00 0.00 H new ATOM 0 HD2 LYS A 751 -3.729 5.810 -9.488 1.00 0.00 H new ATOM 0 HD3 LYS A 751 -4.449 4.805 -8.245 1.00 0.00 H new ATOM 0 HE2 LYS A 751 -5.795 4.497 -10.196 1.00 0.00 H new ATOM 0 HE3 LYS A 751 -6.737 5.510 -9.119 1.00 0.00 H new ATOM 0 HZ1 LYS A 751 -6.693 6.257 -11.460 1.00 0.00 H new ATOM 0 HZ2 LYS A 751 -6.157 7.435 -10.361 1.00 0.00 H new ATOM 0 HZ3 LYS A 751 -5.033 6.578 -11.302 1.00 0.00 H new ATOM 944 N LYS A 752 -8.307 7.599 -5.485 1.00 0.00 N ATOM 945 CA LYS A 752 -9.520 7.346 -4.844 1.00 0.00 C ATOM 946 C LYS A 752 -10.148 6.158 -5.499 1.00 0.00 C ATOM 947 O LYS A 752 -10.092 5.979 -6.729 1.00 0.00 O ATOM 948 CB LYS A 752 -10.453 8.559 -4.937 1.00 0.00 C ATOM 949 CG LYS A 752 -9.937 9.795 -4.218 1.00 0.00 C ATOM 950 CD LYS A 752 -10.831 11.007 -4.445 1.00 0.00 C ATOM 951 CE LYS A 752 -10.858 11.411 -5.916 1.00 0.00 C ATOM 952 NZ LYS A 752 -11.666 12.618 -6.143 1.00 0.00 N ATOM 0 H LYS A 752 -8.437 7.950 -6.434 1.00 0.00 H new ATOM 0 HA LYS A 752 -9.344 7.150 -3.786 1.00 0.00 H new ATOM 0 HB2 LYS A 752 -10.611 8.802 -5.988 1.00 0.00 H new ATOM 0 HB3 LYS A 752 -11.424 8.289 -4.522 1.00 0.00 H new ATOM 0 HG2 LYS A 752 -9.870 9.590 -3.150 1.00 0.00 H new ATOM 0 HG3 LYS A 752 -8.928 10.020 -4.564 1.00 0.00 H new ATOM 0 HD2 LYS A 752 -11.843 10.782 -4.109 1.00 0.00 H new ATOM 0 HD3 LYS A 752 -10.474 11.843 -3.843 1.00 0.00 H new ATOM 0 HE2 LYS A 752 -9.839 11.587 -6.262 1.00 0.00 H new ATOM 0 HE3 LYS A 752 -11.259 10.590 -6.510 1.00 0.00 H new ATOM 0 HZ1 LYS A 752 -11.657 12.857 -7.155 1.00 0.00 H new ATOM 0 HZ2 LYS A 752 -12.645 12.443 -5.837 1.00 0.00 H new ATOM 0 HZ3 LYS A 752 -11.269 13.409 -5.597 1.00 0.00 H new ATOM 966 N CYS A 753 -10.666 5.358 -4.687 1.00 0.00 N ATOM 967 CA CYS A 753 -11.349 4.147 -5.051 1.00 0.00 C ATOM 968 C CYS A 753 -12.792 4.431 -5.371 1.00 0.00 C ATOM 969 O CYS A 753 -13.251 5.576 -5.283 1.00 0.00 O ATOM 970 CB CYS A 753 -11.286 3.140 -3.916 1.00 0.00 C ATOM 971 SG CYS A 753 -9.603 2.637 -3.449 1.00 0.00 S ATOM 0 H CYS A 753 -10.640 5.512 -3.679 1.00 0.00 H new ATOM 0 HA CYS A 753 -10.855 3.736 -5.931 1.00 0.00 H new ATOM 0 HB2 CYS A 753 -11.781 3.565 -3.042 1.00 0.00 H new ATOM 0 HB3 CYS A 753 -11.851 2.253 -4.202 1.00 0.00 H new ATOM 976 N LYS A 754 -13.494 3.411 -5.731 1.00 0.00 N ATOM 977 CA LYS A 754 -14.870 3.500 -6.057 1.00 0.00 C ATOM 978 C LYS A 754 -15.557 2.277 -5.502 1.00 0.00 C ATOM 979 O LYS A 754 -14.954 1.195 -5.453 1.00 0.00 O ATOM 980 CB LYS A 754 -15.012 3.550 -7.582 1.00 0.00 C ATOM 981 CG LYS A 754 -16.432 3.591 -8.095 1.00 0.00 C ATOM 982 CD LYS A 754 -16.461 3.437 -9.601 1.00 0.00 C ATOM 983 CE LYS A 754 -17.879 3.306 -10.124 1.00 0.00 C ATOM 984 NZ LYS A 754 -18.604 2.196 -9.467 1.00 0.00 N ATOM 0 H LYS A 754 -13.113 2.468 -5.808 1.00 0.00 H new ATOM 0 HA LYS A 754 -15.321 4.397 -5.633 1.00 0.00 H new ATOM 0 HB2 LYS A 754 -14.484 4.429 -7.951 1.00 0.00 H new ATOM 0 HB3 LYS A 754 -14.515 2.678 -8.006 1.00 0.00 H new ATOM 0 HG2 LYS A 754 -17.015 2.795 -7.632 1.00 0.00 H new ATOM 0 HG3 LYS A 754 -16.899 4.534 -7.812 1.00 0.00 H new ATOM 0 HD2 LYS A 754 -15.980 4.299 -10.064 1.00 0.00 H new ATOM 0 HD3 LYS A 754 -15.884 2.558 -9.888 1.00 0.00 H new ATOM 0 HE2 LYS A 754 -18.416 4.240 -9.958 1.00 0.00 H new ATOM 0 HE3 LYS A 754 -17.856 3.139 -11.201 1.00 0.00 H new ATOM 0 HZ1 LYS A 754 -19.182 1.694 -10.171 1.00 0.00 H new ATOM 0 HZ2 LYS A 754 -17.920 1.536 -9.046 1.00 0.00 H new ATOM 0 HZ3 LYS A 754 -19.221 2.577 -8.722 1.00 0.00 H new ATOM 998 N SER A 755 -16.742 2.465 -4.998 1.00 0.00 N ATOM 999 CA SER A 755 -17.568 1.371 -4.564 1.00 0.00 C ATOM 1000 C SER A 755 -17.915 0.462 -5.744 1.00 0.00 C ATOM 1001 O SER A 755 -18.342 0.930 -6.812 1.00 0.00 O ATOM 1002 CB SER A 755 -18.837 1.919 -3.905 1.00 0.00 C ATOM 1003 OG SER A 755 -19.373 2.999 -4.660 1.00 0.00 O ATOM 0 H SER A 755 -17.166 3.384 -4.875 1.00 0.00 H new ATOM 0 HA SER A 755 -17.021 0.775 -3.833 1.00 0.00 H new ATOM 0 HB2 SER A 755 -19.579 1.125 -3.820 1.00 0.00 H new ATOM 0 HB3 SER A 755 -18.611 2.254 -2.893 1.00 0.00 H new ATOM 0 HG SER A 755 -20.184 3.333 -4.223 1.00 0.00 H new ATOM 1009 N SER A 756 -17.678 -0.809 -5.578 1.00 0.00 N ATOM 1010 CA SER A 756 -18.026 -1.774 -6.563 1.00 0.00 C ATOM 1011 C SER A 756 -19.564 -1.989 -6.504 1.00 0.00 C ATOM 1012 O SER A 756 -20.208 -1.626 -5.510 1.00 0.00 O ATOM 1013 CB SER A 756 -17.266 -3.044 -6.240 1.00 0.00 C ATOM 1014 OG SER A 756 -15.889 -2.760 -6.000 1.00 0.00 O ATOM 0 H SER A 756 -17.234 -1.200 -4.747 1.00 0.00 H new ATOM 0 HA SER A 756 -17.766 -1.455 -7.572 1.00 0.00 H new ATOM 0 HB2 SER A 756 -17.702 -3.522 -5.363 1.00 0.00 H new ATOM 0 HB3 SER A 756 -17.358 -3.749 -7.066 1.00 0.00 H new ATOM 0 HG SER A 756 -15.415 -3.592 -5.791 1.00 0.00 H new ATOM 1020 N ASN A 757 -20.141 -2.565 -7.525 1.00 0.00 N ATOM 1021 CA ASN A 757 -21.603 -2.685 -7.607 1.00 0.00 C ATOM 1022 C ASN A 757 -22.149 -3.948 -6.986 1.00 0.00 C ATOM 1023 O ASN A 757 -23.347 -4.038 -6.707 1.00 0.00 O ATOM 1024 CB ASN A 757 -22.105 -2.576 -9.054 1.00 0.00 C ATOM 1025 CG ASN A 757 -21.927 -1.199 -9.644 1.00 0.00 C ATOM 1026 OD1 ASN A 757 -22.793 -0.331 -9.483 1.00 0.00 O ATOM 1027 ND2 ASN A 757 -20.864 -0.996 -10.376 1.00 0.00 N ATOM 0 H ASN A 757 -19.637 -2.963 -8.318 1.00 0.00 H new ATOM 0 HA ASN A 757 -21.979 -1.845 -7.023 1.00 0.00 H new ATOM 0 HB2 ASN A 757 -21.573 -3.300 -9.671 1.00 0.00 H new ATOM 0 HB3 ASN A 757 -23.161 -2.844 -9.086 1.00 0.00 H new ATOM 0 HD21 ASN A 757 -20.727 -0.097 -10.838 1.00 0.00 H new ATOM 0 HD22 ASN A 757 -20.171 -1.736 -10.485 1.00 0.00 H new ATOM 1034 N LEU A 758 -21.295 -4.909 -6.738 1.00 0.00 N ATOM 1035 CA LEU A 758 -21.768 -6.199 -6.254 1.00 0.00 C ATOM 1036 C LEU A 758 -21.726 -6.236 -4.737 1.00 0.00 C ATOM 1037 O LEU A 758 -22.391 -7.046 -4.092 1.00 0.00 O ATOM 1038 CB LEU A 758 -20.894 -7.332 -6.815 1.00 0.00 C ATOM 1039 CG LEU A 758 -20.661 -7.353 -8.336 1.00 0.00 C ATOM 1040 CD1 LEU A 758 -19.857 -8.573 -8.731 1.00 0.00 C ATOM 1041 CD2 LEU A 758 -21.967 -7.306 -9.103 1.00 0.00 C ATOM 0 H LEU A 758 -20.285 -4.835 -6.858 1.00 0.00 H new ATOM 0 HA LEU A 758 -22.795 -6.337 -6.591 1.00 0.00 H new ATOM 0 HB2 LEU A 758 -19.922 -7.283 -6.325 1.00 0.00 H new ATOM 0 HB3 LEU A 758 -21.347 -8.281 -6.529 1.00 0.00 H new ATOM 0 HG LEU A 758 -20.095 -6.459 -8.596 1.00 0.00 H new ATOM 0 HD11 LEU A 758 -19.701 -8.572 -9.810 1.00 0.00 H new ATOM 0 HD12 LEU A 758 -18.892 -8.552 -8.225 1.00 0.00 H new ATOM 0 HD13 LEU A 758 -20.398 -9.474 -8.443 1.00 0.00 H new ATOM 0 HD21 LEU A 758 -21.761 -7.322 -10.173 1.00 0.00 H new ATOM 0 HD22 LEU A 758 -22.576 -8.170 -8.837 1.00 0.00 H new ATOM 0 HD23 LEU A 758 -22.504 -6.392 -8.851 1.00 0.00 H new ATOM 1053 N ILE A 759 -20.962 -5.334 -4.183 1.00 0.00 N ATOM 1054 CA ILE A 759 -20.709 -5.297 -2.783 1.00 0.00 C ATOM 1055 C ILE A 759 -21.524 -4.290 -2.041 1.00 0.00 C ATOM 1056 O ILE A 759 -22.071 -3.336 -2.615 1.00 0.00 O ATOM 1057 CB ILE A 759 -19.207 -5.154 -2.473 1.00 0.00 C ATOM 1058 CG1 ILE A 759 -18.541 -4.086 -3.332 1.00 0.00 C ATOM 1059 CG2 ILE A 759 -18.512 -6.469 -2.678 1.00 0.00 C ATOM 1060 CD1 ILE A 759 -18.624 -2.710 -2.777 1.00 0.00 C ATOM 0 H ILE A 759 -20.494 -4.595 -4.708 1.00 0.00 H new ATOM 0 HA ILE A 759 -21.038 -6.267 -2.410 1.00 0.00 H new ATOM 0 HB ILE A 759 -19.120 -4.845 -1.431 1.00 0.00 H new ATOM 0 HG12 ILE A 759 -17.491 -4.348 -3.466 1.00 0.00 H new ATOM 0 HG13 ILE A 759 -19.000 -4.094 -4.321 1.00 0.00 H new ATOM 0 HG21 ILE A 759 -17.451 -6.358 -2.456 1.00 0.00 H new ATOM 0 HG22 ILE A 759 -18.945 -7.217 -2.014 1.00 0.00 H new ATOM 0 HG23 ILE A 759 -18.635 -6.788 -3.713 1.00 0.00 H new ATOM 0 HD11 ILE A 759 -18.125 -2.015 -3.452 1.00 0.00 H new ATOM 0 HD12 ILE A 759 -19.670 -2.424 -2.670 1.00 0.00 H new ATOM 0 HD13 ILE A 759 -18.138 -2.681 -1.802 1.00 0.00 H new ATOM 1072 N ILE A 760 -21.600 -4.524 -0.781 1.00 0.00 N ATOM 1073 CA ILE A 760 -22.320 -3.706 0.131 1.00 0.00 C ATOM 1074 C ILE A 760 -21.307 -3.162 1.097 1.00 0.00 C ATOM 1075 O ILE A 760 -20.419 -3.904 1.535 1.00 0.00 O ATOM 1076 CB ILE A 760 -23.388 -4.514 0.956 1.00 0.00 C ATOM 1077 CG1 ILE A 760 -24.413 -5.270 0.082 1.00 0.00 C ATOM 1078 CG2 ILE A 760 -24.130 -3.608 1.931 1.00 0.00 C ATOM 1079 CD1 ILE A 760 -23.903 -6.546 -0.550 1.00 0.00 C ATOM 0 H ILE A 760 -21.145 -5.322 -0.338 1.00 0.00 H new ATOM 0 HA ILE A 760 -22.852 -2.935 -0.426 1.00 0.00 H new ATOM 0 HB ILE A 760 -22.816 -5.264 1.502 1.00 0.00 H new ATOM 0 HG12 ILE A 760 -25.282 -5.509 0.694 1.00 0.00 H new ATOM 0 HG13 ILE A 760 -24.754 -4.603 -0.709 1.00 0.00 H new ATOM 0 HG21 ILE A 760 -24.862 -4.194 2.487 1.00 0.00 H new ATOM 0 HG22 ILE A 760 -23.419 -3.161 2.626 1.00 0.00 H new ATOM 0 HG23 ILE A 760 -24.641 -2.820 1.378 1.00 0.00 H new ATOM 0 HD11 ILE A 760 -24.697 -7.001 -1.143 1.00 0.00 H new ATOM 0 HD12 ILE A 760 -23.054 -6.319 -1.194 1.00 0.00 H new ATOM 0 HD13 ILE A 760 -23.590 -7.239 0.231 1.00 0.00 H new ATOM 1091 N LEU A 761 -21.394 -1.911 1.392 1.00 0.00 N ATOM 1092 CA LEU A 761 -20.492 -1.310 2.331 1.00 0.00 C ATOM 1093 C LEU A 761 -21.247 -0.960 3.590 1.00 0.00 C ATOM 1094 O LEU A 761 -22.460 -1.244 3.707 1.00 0.00 O ATOM 1095 CB LEU A 761 -19.810 -0.045 1.747 1.00 0.00 C ATOM 1096 CG LEU A 761 -19.020 -0.213 0.434 1.00 0.00 C ATOM 1097 CD1 LEU A 761 -18.121 -1.412 0.465 1.00 0.00 C ATOM 1098 CD2 LEU A 761 -19.924 -0.171 -0.788 1.00 0.00 C ATOM 0 H LEU A 761 -22.085 -1.274 0.996 1.00 0.00 H new ATOM 0 HA LEU A 761 -19.704 -2.028 2.556 1.00 0.00 H new ATOM 0 HB2 LEU A 761 -20.580 0.709 1.584 1.00 0.00 H new ATOM 0 HB3 LEU A 761 -19.131 0.351 2.502 1.00 0.00 H new ATOM 0 HG LEU A 761 -18.360 0.650 0.344 1.00 0.00 H new ATOM 0 HD11 LEU A 761 -17.585 -1.489 -0.481 1.00 0.00 H new ATOM 0 HD12 LEU A 761 -17.405 -1.309 1.280 1.00 0.00 H new ATOM 0 HD13 LEU A 761 -18.718 -2.311 0.618 1.00 0.00 H new ATOM 0 HD21 LEU A 761 -19.323 -0.293 -1.689 1.00 0.00 H new ATOM 0 HD22 LEU A 761 -20.656 -0.977 -0.727 1.00 0.00 H new ATOM 0 HD23 LEU A 761 -20.442 0.787 -0.825 1.00 0.00 H new ATOM 1110 N GLU A 762 -20.545 -0.387 4.534 1.00 0.00 N ATOM 1111 CA GLU A 762 -21.136 0.078 5.763 1.00 0.00 C ATOM 1112 C GLU A 762 -22.125 1.183 5.448 1.00 0.00 C ATOM 1113 O GLU A 762 -21.979 1.873 4.450 1.00 0.00 O ATOM 1114 CB GLU A 762 -20.056 0.615 6.672 1.00 0.00 C ATOM 1115 CG GLU A 762 -18.999 -0.399 7.034 1.00 0.00 C ATOM 1116 CD GLU A 762 -17.930 0.202 7.882 1.00 0.00 C ATOM 1117 OE1 GLU A 762 -18.179 0.438 9.088 1.00 0.00 O ATOM 1118 OE2 GLU A 762 -16.845 0.467 7.370 1.00 0.00 O ATOM 0 H GLU A 762 -19.539 -0.229 4.471 1.00 0.00 H new ATOM 0 HA GLU A 762 -21.648 -0.746 6.260 1.00 0.00 H new ATOM 0 HB2 GLU A 762 -19.578 1.466 6.188 1.00 0.00 H new ATOM 0 HB3 GLU A 762 -20.517 0.987 7.587 1.00 0.00 H new ATOM 0 HG2 GLU A 762 -19.460 -1.232 7.565 1.00 0.00 H new ATOM 0 HG3 GLU A 762 -18.557 -0.806 6.124 1.00 0.00 H new ATOM 1125 N GLU A 763 -23.066 1.412 6.321 1.00 0.00 N ATOM 1126 CA GLU A 763 -24.125 2.393 6.076 1.00 0.00 C ATOM 1127 C GLU A 763 -23.564 3.811 6.056 1.00 0.00 C ATOM 1128 O GLU A 763 -24.151 4.717 5.480 1.00 0.00 O ATOM 1129 CB GLU A 763 -25.235 2.245 7.102 1.00 0.00 C ATOM 1130 CG GLU A 763 -25.866 0.864 7.092 1.00 0.00 C ATOM 1131 CD GLU A 763 -26.967 0.718 8.097 1.00 0.00 C ATOM 1132 OE1 GLU A 763 -28.127 1.017 7.762 1.00 0.00 O ATOM 1133 OE2 GLU A 763 -26.695 0.304 9.247 1.00 0.00 O ATOM 0 H GLU A 763 -23.134 0.936 7.221 1.00 0.00 H new ATOM 0 HA GLU A 763 -24.552 2.200 5.092 1.00 0.00 H new ATOM 0 HB2 GLU A 763 -24.835 2.449 8.095 1.00 0.00 H new ATOM 0 HB3 GLU A 763 -26.004 2.992 6.908 1.00 0.00 H new ATOM 0 HG2 GLU A 763 -26.260 0.657 6.097 1.00 0.00 H new ATOM 0 HG3 GLU A 763 -25.097 0.118 7.292 1.00 0.00 H new ATOM 1140 N HIS A 764 -22.375 3.951 6.620 1.00 0.00 N ATOM 1141 CA HIS A 764 -21.659 5.222 6.662 1.00 0.00 C ATOM 1142 C HIS A 764 -20.673 5.324 5.521 1.00 0.00 C ATOM 1143 O HIS A 764 -19.958 6.310 5.388 1.00 0.00 O ATOM 1144 CB HIS A 764 -20.955 5.484 8.036 1.00 0.00 C ATOM 1145 CG HIS A 764 -20.520 4.278 8.838 1.00 0.00 C ATOM 1146 ND1 HIS A 764 -21.331 3.650 9.740 1.00 0.00 N ATOM 1147 CD2 HIS A 764 -19.358 3.607 8.880 1.00 0.00 C ATOM 1148 CE1 HIS A 764 -20.694 2.650 10.295 1.00 0.00 C ATOM 1149 NE2 HIS A 764 -19.494 2.600 9.788 1.00 0.00 N ATOM 0 H HIS A 764 -21.874 3.182 7.065 1.00 0.00 H new ATOM 0 HA HIS A 764 -22.410 6.004 6.547 1.00 0.00 H new ATOM 0 HB2 HIS A 764 -20.075 6.100 7.851 1.00 0.00 H new ATOM 0 HB3 HIS A 764 -21.633 6.073 8.654 1.00 0.00 H new ATOM 0 HD2 HIS A 764 -18.474 3.826 8.299 1.00 0.00 H new ATOM 0 HE1 HIS A 764 -21.094 1.982 11.044 1.00 0.00 H new ATOM 0 HE2 HIS A 764 -18.775 1.919 10.031 1.00 0.00 H new ATOM 1158 N LEU A 765 -20.626 4.281 4.709 1.00 0.00 N ATOM 1159 CA LEU A 765 -19.737 4.225 3.574 1.00 0.00 C ATOM 1160 C LEU A 765 -20.466 3.953 2.258 1.00 0.00 C ATOM 1161 O LEU A 765 -19.891 4.099 1.196 1.00 0.00 O ATOM 1162 CB LEU A 765 -18.608 3.210 3.790 1.00 0.00 C ATOM 1163 CG LEU A 765 -17.397 3.666 4.622 1.00 0.00 C ATOM 1164 CD1 LEU A 765 -16.821 4.967 4.104 1.00 0.00 C ATOM 1165 CD2 LEU A 765 -17.699 3.762 6.088 1.00 0.00 C ATOM 0 H LEU A 765 -21.207 3.450 4.824 1.00 0.00 H new ATOM 0 HA LEU A 765 -19.295 5.218 3.491 1.00 0.00 H new ATOM 0 HB2 LEU A 765 -19.034 2.329 4.270 1.00 0.00 H new ATOM 0 HB3 LEU A 765 -18.245 2.896 2.811 1.00 0.00 H new ATOM 0 HG LEU A 765 -16.642 2.888 4.505 1.00 0.00 H new ATOM 0 HD11 LEU A 765 -15.968 5.257 4.717 1.00 0.00 H new ATOM 0 HD12 LEU A 765 -16.498 4.836 3.071 1.00 0.00 H new ATOM 0 HD13 LEU A 765 -17.582 5.746 4.150 1.00 0.00 H new ATOM 0 HD21 LEU A 765 -16.807 4.088 6.623 1.00 0.00 H new ATOM 0 HD22 LEU A 765 -18.501 4.482 6.248 1.00 0.00 H new ATOM 0 HD23 LEU A 765 -18.009 2.785 6.460 1.00 0.00 H new ATOM 1177 N LYS A 766 -21.737 3.568 2.316 1.00 0.00 N ATOM 1178 CA LYS A 766 -22.513 3.356 1.094 1.00 0.00 C ATOM 1179 C LYS A 766 -22.784 4.675 0.399 1.00 0.00 C ATOM 1180 O LYS A 766 -22.996 4.733 -0.810 1.00 0.00 O ATOM 1181 CB LYS A 766 -23.821 2.605 1.369 1.00 0.00 C ATOM 1182 CG LYS A 766 -23.604 1.195 1.882 1.00 0.00 C ATOM 1183 CD LYS A 766 -24.879 0.356 1.927 1.00 0.00 C ATOM 1184 CE LYS A 766 -25.931 0.885 2.888 1.00 0.00 C ATOM 1185 NZ LYS A 766 -27.094 -0.033 2.954 1.00 0.00 N ATOM 0 H LYS A 766 -22.248 3.398 3.182 1.00 0.00 H new ATOM 0 HA LYS A 766 -21.915 2.730 0.432 1.00 0.00 H new ATOM 0 HB2 LYS A 766 -24.407 3.164 2.099 1.00 0.00 H new ATOM 0 HB3 LYS A 766 -24.409 2.565 0.452 1.00 0.00 H new ATOM 0 HG2 LYS A 766 -22.873 0.695 1.247 1.00 0.00 H new ATOM 0 HG3 LYS A 766 -23.176 1.244 2.883 1.00 0.00 H new ATOM 0 HD2 LYS A 766 -25.307 0.309 0.926 1.00 0.00 H new ATOM 0 HD3 LYS A 766 -24.621 -0.664 2.212 1.00 0.00 H new ATOM 0 HE2 LYS A 766 -25.497 1.001 3.881 1.00 0.00 H new ATOM 0 HE3 LYS A 766 -26.260 1.873 2.566 1.00 0.00 H new ATOM 0 HZ1 LYS A 766 -27.800 0.348 3.616 1.00 0.00 H new ATOM 0 HZ2 LYS A 766 -27.519 -0.123 2.009 1.00 0.00 H new ATOM 0 HZ3 LYS A 766 -26.780 -0.968 3.283 1.00 0.00 H new ATOM 1199 N ASN A 767 -22.691 5.739 1.167 1.00 0.00 N ATOM 1200 CA ASN A 767 -22.921 7.093 0.686 1.00 0.00 C ATOM 1201 C ASN A 767 -21.625 7.682 0.139 1.00 0.00 C ATOM 1202 O ASN A 767 -21.523 8.888 -0.086 1.00 0.00 O ATOM 1203 CB ASN A 767 -23.433 7.982 1.827 1.00 0.00 C ATOM 1204 CG ASN A 767 -24.771 7.548 2.399 1.00 0.00 C ATOM 1205 OD1 ASN A 767 -25.629 6.997 1.696 1.00 0.00 O ATOM 1206 ND2 ASN A 767 -24.941 7.739 3.682 1.00 0.00 N ATOM 0 H ASN A 767 -22.451 5.692 2.157 1.00 0.00 H new ATOM 0 HA ASN A 767 -23.668 7.054 -0.107 1.00 0.00 H new ATOM 0 HB2 ASN A 767 -22.693 7.989 2.627 1.00 0.00 H new ATOM 0 HB3 ASN A 767 -23.520 9.006 1.464 1.00 0.00 H new ATOM 0 HD21 ASN A 767 -25.802 7.430 4.134 1.00 0.00 H new ATOM 0 HD22 ASN A 767 -24.213 8.196 4.230 1.00 0.00 H new ATOM 1213 N LYS A 768 -20.648 6.837 -0.076 1.00 0.00 N ATOM 1214 CA LYS A 768 -19.379 7.229 -0.578 1.00 0.00 C ATOM 1215 C LYS A 768 -19.283 6.676 -1.977 1.00 0.00 C ATOM 1216 O LYS A 768 -19.372 5.465 -2.162 1.00 0.00 O ATOM 1217 CB LYS A 768 -18.285 6.577 0.269 1.00 0.00 C ATOM 1218 CG LYS A 768 -16.881 7.057 -0.024 1.00 0.00 C ATOM 1219 CD LYS A 768 -16.540 8.326 0.718 1.00 0.00 C ATOM 1220 CE LYS A 768 -16.448 8.080 2.216 1.00 0.00 C ATOM 1221 NZ LYS A 768 -16.006 9.282 2.951 1.00 0.00 N ATOM 0 H LYS A 768 -20.727 5.836 0.101 1.00 0.00 H new ATOM 0 HA LYS A 768 -19.263 8.313 -0.557 1.00 0.00 H new ATOM 0 HB2 LYS A 768 -18.503 6.759 1.321 1.00 0.00 H new ATOM 0 HB3 LYS A 768 -18.323 5.498 0.118 1.00 0.00 H new ATOM 0 HG2 LYS A 768 -16.169 6.278 0.248 1.00 0.00 H new ATOM 0 HG3 LYS A 768 -16.774 7.226 -1.095 1.00 0.00 H new ATOM 0 HD2 LYS A 768 -15.592 8.720 0.353 1.00 0.00 H new ATOM 0 HD3 LYS A 768 -17.298 9.083 0.517 1.00 0.00 H new ATOM 0 HE2 LYS A 768 -17.421 7.764 2.591 1.00 0.00 H new ATOM 0 HE3 LYS A 768 -15.752 7.263 2.407 1.00 0.00 H new ATOM 0 HZ1 LYS A 768 -15.957 9.069 3.968 1.00 0.00 H new ATOM 0 HZ2 LYS A 768 -15.066 9.570 2.612 1.00 0.00 H new ATOM 0 HZ3 LYS A 768 -16.683 10.055 2.791 1.00 0.00 H new ATOM 1235 N LYS A 769 -19.174 7.527 -2.948 1.00 0.00 N ATOM 1236 CA LYS A 769 -18.994 7.086 -4.311 1.00 0.00 C ATOM 1237 C LYS A 769 -17.533 6.751 -4.500 1.00 0.00 C ATOM 1238 O LYS A 769 -17.160 5.708 -5.059 1.00 0.00 O ATOM 1239 CB LYS A 769 -19.379 8.216 -5.264 1.00 0.00 C ATOM 1240 CG LYS A 769 -19.240 7.880 -6.744 1.00 0.00 C ATOM 1241 CD LYS A 769 -19.529 9.094 -7.618 1.00 0.00 C ATOM 1242 CE LYS A 769 -20.916 9.650 -7.351 1.00 0.00 C ATOM 1243 NZ LYS A 769 -21.204 10.861 -8.149 1.00 0.00 N ATOM 0 H LYS A 769 -19.206 8.540 -2.829 1.00 0.00 H new ATOM 0 HA LYS A 769 -19.618 6.216 -4.517 1.00 0.00 H new ATOM 0 HB2 LYS A 769 -20.412 8.503 -5.067 1.00 0.00 H new ATOM 0 HB3 LYS A 769 -18.759 9.085 -5.044 1.00 0.00 H new ATOM 0 HG2 LYS A 769 -18.232 7.518 -6.943 1.00 0.00 H new ATOM 0 HG3 LYS A 769 -19.925 7.073 -7.002 1.00 0.00 H new ATOM 0 HD2 LYS A 769 -18.783 9.866 -7.429 1.00 0.00 H new ATOM 0 HD3 LYS A 769 -19.442 8.817 -8.669 1.00 0.00 H new ATOM 0 HE2 LYS A 769 -21.660 8.885 -7.576 1.00 0.00 H new ATOM 0 HE3 LYS A 769 -21.011 9.886 -6.291 1.00 0.00 H new ATOM 0 HZ1 LYS A 769 -22.162 11.201 -7.930 1.00 0.00 H new ATOM 0 HZ2 LYS A 769 -20.512 11.602 -7.917 1.00 0.00 H new ATOM 0 HZ3 LYS A 769 -21.140 10.633 -9.162 1.00 0.00 H new ATOM 1257 N GLU A 770 -16.715 7.617 -3.968 1.00 0.00 N ATOM 1258 CA GLU A 770 -15.297 7.530 -4.125 1.00 0.00 C ATOM 1259 C GLU A 770 -14.638 7.536 -2.796 1.00 0.00 C ATOM 1260 O GLU A 770 -14.727 8.509 -2.045 1.00 0.00 O ATOM 1261 CB GLU A 770 -14.771 8.686 -4.950 1.00 0.00 C ATOM 1262 CG GLU A 770 -15.349 8.763 -6.336 1.00 0.00 C ATOM 1263 CD GLU A 770 -14.795 9.912 -7.095 1.00 0.00 C ATOM 1264 OE1 GLU A 770 -13.755 9.747 -7.763 1.00 0.00 O ATOM 1265 OE2 GLU A 770 -15.382 11.010 -7.034 1.00 0.00 O ATOM 0 H GLU A 770 -17.023 8.411 -3.407 1.00 0.00 H new ATOM 0 HA GLU A 770 -15.071 6.598 -4.644 1.00 0.00 H new ATOM 0 HB2 GLU A 770 -14.984 9.618 -4.427 1.00 0.00 H new ATOM 0 HB3 GLU A 770 -13.687 8.602 -5.024 1.00 0.00 H new ATOM 0 HG2 GLU A 770 -15.138 7.837 -6.871 1.00 0.00 H new ATOM 0 HG3 GLU A 770 -16.433 8.856 -6.274 1.00 0.00 H new ATOM 1272 N PHE A 771 -13.974 6.480 -2.507 1.00 0.00 N ATOM 1273 CA PHE A 771 -13.312 6.336 -1.250 1.00 0.00 C ATOM 1274 C PHE A 771 -11.924 6.842 -1.381 1.00 0.00 C ATOM 1275 O PHE A 771 -11.243 6.552 -2.362 1.00 0.00 O ATOM 1276 CB PHE A 771 -13.266 4.884 -0.820 1.00 0.00 C ATOM 1277 CG PHE A 771 -14.602 4.254 -0.608 1.00 0.00 C ATOM 1278 CD1 PHE A 771 -15.312 3.732 -1.671 1.00 0.00 C ATOM 1279 CD2 PHE A 771 -15.134 4.161 0.658 1.00 0.00 C ATOM 1280 CE1 PHE A 771 -16.527 3.135 -1.473 1.00 0.00 C ATOM 1281 CE2 PHE A 771 -16.357 3.566 0.864 1.00 0.00 C ATOM 1282 CZ PHE A 771 -17.057 3.048 -0.205 1.00 0.00 C ATOM 0 H PHE A 771 -13.869 5.682 -3.134 1.00 0.00 H new ATOM 0 HA PHE A 771 -13.863 6.902 -0.499 1.00 0.00 H new ATOM 0 HB2 PHE A 771 -12.726 4.313 -1.575 1.00 0.00 H new ATOM 0 HB3 PHE A 771 -12.694 4.811 0.105 1.00 0.00 H new ATOM 0 HD1 PHE A 771 -14.904 3.796 -2.669 1.00 0.00 H new ATOM 0 HD2 PHE A 771 -14.585 4.559 1.499 1.00 0.00 H new ATOM 0 HE1 PHE A 771 -17.072 2.731 -2.313 1.00 0.00 H new ATOM 0 HE2 PHE A 771 -16.768 3.505 1.861 1.00 0.00 H new ATOM 0 HZ PHE A 771 -18.016 2.576 -0.049 1.00 0.00 H new ATOM 1292 N ASP A 772 -11.494 7.578 -0.431 1.00 0.00 N ATOM 1293 CA ASP A 772 -10.158 8.075 -0.461 1.00 0.00 C ATOM 1294 C ASP A 772 -9.215 6.998 -0.037 1.00 0.00 C ATOM 1295 O ASP A 772 -9.550 6.134 0.766 1.00 0.00 O ATOM 1296 CB ASP A 772 -9.947 9.337 0.405 1.00 0.00 C ATOM 1297 CG ASP A 772 -10.417 10.627 -0.249 1.00 0.00 C ATOM 1298 OD1 ASP A 772 -11.589 11.004 -0.086 1.00 0.00 O ATOM 1299 OD2 ASP A 772 -9.601 11.313 -0.911 1.00 0.00 O ATOM 0 H ASP A 772 -12.042 7.856 0.383 1.00 0.00 H new ATOM 0 HA ASP A 772 -9.957 8.376 -1.489 1.00 0.00 H new ATOM 0 HB2 ASP A 772 -10.475 9.208 1.350 1.00 0.00 H new ATOM 0 HB3 ASP A 772 -8.887 9.428 0.642 1.00 0.00 H new ATOM 1304 N HIS A 773 -8.091 6.992 -0.669 1.00 0.00 N ATOM 1305 CA HIS A 773 -6.957 6.166 -0.331 1.00 0.00 C ATOM 1306 C HIS A 773 -6.754 6.069 1.212 1.00 0.00 C ATOM 1307 O HIS A 773 -6.912 7.060 1.926 1.00 0.00 O ATOM 1308 CB HIS A 773 -5.726 6.796 -0.995 1.00 0.00 C ATOM 1309 CG HIS A 773 -5.511 8.239 -0.566 1.00 0.00 C ATOM 1310 ND1 HIS A 773 -6.218 9.315 -1.073 1.00 0.00 N ATOM 1311 CD2 HIS A 773 -4.764 8.725 0.411 1.00 0.00 C ATOM 1312 CE1 HIS A 773 -5.926 10.389 -0.380 1.00 0.00 C ATOM 1313 NE2 HIS A 773 -5.050 10.061 0.530 1.00 0.00 N ATOM 0 H HIS A 773 -7.918 7.589 -1.478 1.00 0.00 H new ATOM 0 HA HIS A 773 -7.119 5.149 -0.687 1.00 0.00 H new ATOM 0 HB2 HIS A 773 -4.842 6.210 -0.745 1.00 0.00 H new ATOM 0 HB3 HIS A 773 -5.840 6.755 -2.078 1.00 0.00 H new ATOM 0 HD1 HIS A 773 -6.864 9.278 -1.861 1.00 0.00 H new ATOM 0 HD2 HIS A 773 -4.056 8.170 1.008 1.00 0.00 H new ATOM 0 HE1 HIS A 773 -6.339 11.375 -0.535 1.00 0.00 H new ATOM 1322 N ASN A 774 -6.438 4.867 1.674 1.00 0.00 N ATOM 1323 CA ASN A 774 -6.166 4.528 3.086 1.00 0.00 C ATOM 1324 C ASN A 774 -7.406 4.483 3.936 1.00 0.00 C ATOM 1325 O ASN A 774 -7.331 4.313 5.144 1.00 0.00 O ATOM 1326 CB ASN A 774 -5.129 5.434 3.699 1.00 0.00 C ATOM 1327 CG ASN A 774 -3.793 5.330 3.022 1.00 0.00 C ATOM 1328 OD1 ASN A 774 -3.350 4.253 2.609 1.00 0.00 O ATOM 1329 ND2 ASN A 774 -3.219 6.452 2.796 1.00 0.00 N ATOM 0 H ASN A 774 -6.358 4.058 1.057 1.00 0.00 H new ATOM 0 HA ASN A 774 -5.761 3.516 3.066 1.00 0.00 H new ATOM 0 HB2 ASN A 774 -5.478 6.465 3.648 1.00 0.00 H new ATOM 0 HB3 ASN A 774 -5.016 5.188 4.755 1.00 0.00 H new ATOM 0 HD21 ASN A 774 -2.356 6.483 2.253 1.00 0.00 H new ATOM 0 HD22 ASN A 774 -3.625 7.315 3.159 1.00 0.00 H new ATOM 1336 N SER A 775 -8.547 4.614 3.318 1.00 0.00 N ATOM 1337 CA SER A 775 -9.775 4.469 4.041 1.00 0.00 C ATOM 1338 C SER A 775 -10.015 3.011 4.312 1.00 0.00 C ATOM 1339 O SER A 775 -10.100 2.194 3.382 1.00 0.00 O ATOM 1340 CB SER A 775 -10.969 5.097 3.323 1.00 0.00 C ATOM 1341 OG SER A 775 -10.850 6.510 3.258 1.00 0.00 O ATOM 0 H SER A 775 -8.650 4.819 2.324 1.00 0.00 H new ATOM 0 HA SER A 775 -9.676 5.012 4.981 1.00 0.00 H new ATOM 0 HB2 SER A 775 -11.044 4.690 2.315 1.00 0.00 H new ATOM 0 HB3 SER A 775 -11.889 4.831 3.843 1.00 0.00 H new ATOM 0 HG SER A 775 -10.393 6.762 2.429 1.00 0.00 H new ATOM 1347 N ASN A 776 -10.028 2.684 5.564 1.00 0.00 N ATOM 1348 CA ASN A 776 -10.279 1.338 6.008 1.00 0.00 C ATOM 1349 C ASN A 776 -11.767 1.152 6.116 1.00 0.00 C ATOM 1350 O ASN A 776 -12.401 1.658 7.046 1.00 0.00 O ATOM 1351 CB ASN A 776 -9.599 1.041 7.369 1.00 0.00 C ATOM 1352 CG ASN A 776 -8.062 1.038 7.349 1.00 0.00 C ATOM 1353 OD1 ASN A 776 -7.449 1.902 6.573 1.00 0.00 O flip ATOM 1354 ND2 ASN A 776 -7.433 0.291 8.079 1.00 0.00 N flip ATOM 0 H ASN A 776 -9.863 3.347 6.321 1.00 0.00 H new ATOM 0 HA ASN A 776 -9.855 0.640 5.286 1.00 0.00 H new ATOM 0 HB2 ASN A 776 -9.935 1.783 8.094 1.00 0.00 H new ATOM 0 HB3 ASN A 776 -9.943 0.070 7.724 1.00 0.00 H new ATOM 0 HD21 ASN A 776 -7.926 -0.374 8.675 1.00 0.00 H new ATOM 0 HD22 ASN A 776 -6.414 0.331 8.094 1.00 0.00 H new ATOM 1361 N ILE A 777 -12.329 0.498 5.145 1.00 0.00 N ATOM 1362 CA ILE A 777 -13.752 0.284 5.095 1.00 0.00 C ATOM 1363 C ILE A 777 -14.052 -1.186 5.245 1.00 0.00 C ATOM 1364 O ILE A 777 -13.149 -2.028 5.333 1.00 0.00 O ATOM 1365 CB ILE A 777 -14.371 0.722 3.745 1.00 0.00 C ATOM 1366 CG1 ILE A 777 -13.783 -0.123 2.607 1.00 0.00 C ATOM 1367 CG2 ILE A 777 -14.117 2.202 3.506 1.00 0.00 C ATOM 1368 CD1 ILE A 777 -14.702 -0.309 1.427 1.00 0.00 C ATOM 0 H ILE A 777 -11.816 0.095 4.361 1.00 0.00 H new ATOM 0 HA ILE A 777 -14.178 0.879 5.903 1.00 0.00 H new ATOM 0 HB ILE A 777 -15.449 0.563 3.776 1.00 0.00 H new ATOM 0 HG12 ILE A 777 -12.861 0.345 2.263 1.00 0.00 H new ATOM 0 HG13 ILE A 777 -13.515 -1.103 3.001 1.00 0.00 H new ATOM 0 HG21 ILE A 777 -14.557 2.498 2.554 1.00 0.00 H new ATOM 0 HG22 ILE A 777 -14.568 2.783 4.310 1.00 0.00 H new ATOM 0 HG23 ILE A 777 -13.043 2.388 3.483 1.00 0.00 H new ATOM 0 HD11 ILE A 777 -14.205 -0.918 0.672 1.00 0.00 H new ATOM 0 HD12 ILE A 777 -15.615 -0.807 1.752 1.00 0.00 H new ATOM 0 HD13 ILE A 777 -14.951 0.664 1.003 1.00 0.00 H new ATOM 1380 N ARG A 778 -15.302 -1.506 5.225 1.00 0.00 N ATOM 1381 CA ARG A 778 -15.728 -2.851 5.261 1.00 0.00 C ATOM 1382 C ARG A 778 -16.668 -3.090 4.114 1.00 0.00 C ATOM 1383 O ARG A 778 -17.672 -2.400 3.990 1.00 0.00 O ATOM 1384 CB ARG A 778 -16.459 -3.148 6.557 1.00 0.00 C ATOM 1385 CG ARG A 778 -15.647 -3.007 7.820 1.00 0.00 C ATOM 1386 CD ARG A 778 -16.509 -3.339 9.013 1.00 0.00 C ATOM 1387 NE ARG A 778 -15.757 -3.383 10.272 1.00 0.00 N ATOM 1388 CZ ARG A 778 -16.293 -3.682 11.466 1.00 0.00 C ATOM 1389 NH1 ARG A 778 -17.606 -3.694 11.615 1.00 0.00 N ATOM 1390 NH2 ARG A 778 -15.514 -3.867 12.518 1.00 0.00 N ATOM 0 H ARG A 778 -16.061 -0.826 5.183 1.00 0.00 H new ATOM 0 HA ARG A 778 -14.855 -3.499 5.190 1.00 0.00 H new ATOM 0 HB2 ARG A 778 -17.320 -2.483 6.626 1.00 0.00 H new ATOM 0 HB3 ARG A 778 -16.845 -4.166 6.508 1.00 0.00 H new ATOM 0 HG2 ARG A 778 -14.784 -3.671 7.786 1.00 0.00 H new ATOM 0 HG3 ARG A 778 -15.264 -1.990 7.907 1.00 0.00 H new ATOM 0 HD2 ARG A 778 -17.304 -2.598 9.097 1.00 0.00 H new ATOM 0 HD3 ARG A 778 -16.989 -4.304 8.850 1.00 0.00 H new ATOM 0 HE ARG A 778 -14.760 -3.172 10.238 1.00 0.00 H new ATOM 0 HH11 ARG A 778 -18.211 -3.476 10.823 1.00 0.00 H new ATOM 0 HH12 ARG A 778 -18.014 -3.921 12.522 1.00 0.00 H new ATOM 0 HH21 ARG A 778 -14.502 -3.783 12.424 1.00 0.00 H new ATOM 0 HH22 ARG A 778 -15.925 -4.094 13.423 1.00 0.00 H new ATOM 1404 N TYR A 779 -16.319 -4.001 3.246 1.00 0.00 N ATOM 1405 CA TYR A 779 -17.248 -4.419 2.232 1.00 0.00 C ATOM 1406 C TYR A 779 -17.730 -5.771 2.644 1.00 0.00 C ATOM 1407 O TYR A 779 -17.093 -6.448 3.494 1.00 0.00 O ATOM 1408 CB TYR A 779 -16.625 -4.535 0.797 1.00 0.00 C ATOM 1409 CG TYR A 779 -15.793 -5.771 0.578 1.00 0.00 C ATOM 1410 CD1 TYR A 779 -14.531 -5.900 1.120 1.00 0.00 C ATOM 1411 CD2 TYR A 779 -16.295 -6.812 -0.177 1.00 0.00 C ATOM 1412 CE1 TYR A 779 -13.779 -7.026 0.910 1.00 0.00 C ATOM 1413 CE2 TYR A 779 -15.564 -7.948 -0.400 1.00 0.00 C ATOM 1414 CZ TYR A 779 -14.300 -8.060 0.142 1.00 0.00 C ATOM 1415 OH TYR A 779 -13.552 -9.199 -0.091 1.00 0.00 O ATOM 0 H TYR A 779 -15.410 -4.463 3.220 1.00 0.00 H new ATOM 0 HA TYR A 779 -18.034 -3.668 2.159 1.00 0.00 H new ATOM 0 HB2 TYR A 779 -17.430 -4.519 0.062 1.00 0.00 H new ATOM 0 HB3 TYR A 779 -16.006 -3.657 0.611 1.00 0.00 H new ATOM 0 HD1 TYR A 779 -14.128 -5.098 1.721 1.00 0.00 H new ATOM 0 HD2 TYR A 779 -17.285 -6.729 -0.601 1.00 0.00 H new ATOM 0 HE1 TYR A 779 -12.791 -7.109 1.337 1.00 0.00 H new ATOM 0 HE2 TYR A 779 -15.974 -8.750 -0.996 1.00 0.00 H new ATOM 0 HH TYR A 779 -14.068 -9.821 -0.646 1.00 0.00 H new ATOM 1425 N ARG A 780 -18.775 -6.163 2.052 1.00 0.00 N ATOM 1426 CA ARG A 780 -19.319 -7.446 2.215 1.00 0.00 C ATOM 1427 C ARG A 780 -19.949 -7.817 0.921 1.00 0.00 C ATOM 1428 O ARG A 780 -20.284 -6.936 0.117 1.00 0.00 O ATOM 1429 CB ARG A 780 -20.309 -7.524 3.361 1.00 0.00 C ATOM 1430 CG ARG A 780 -21.579 -6.772 3.161 1.00 0.00 C ATOM 1431 CD ARG A 780 -22.501 -6.969 4.343 1.00 0.00 C ATOM 1432 NE ARG A 780 -23.701 -6.143 4.250 1.00 0.00 N ATOM 1433 CZ ARG A 780 -24.604 -5.992 5.229 1.00 0.00 C ATOM 1434 NH1 ARG A 780 -24.502 -6.690 6.361 1.00 0.00 N ATOM 1435 NH2 ARG A 780 -25.607 -5.137 5.071 1.00 0.00 N ATOM 0 H ARG A 780 -19.304 -5.574 1.409 1.00 0.00 H new ATOM 0 HA ARG A 780 -18.529 -8.149 2.480 1.00 0.00 H new ATOM 0 HB2 ARG A 780 -20.551 -8.572 3.539 1.00 0.00 H new ATOM 0 HB3 ARG A 780 -19.824 -7.151 4.263 1.00 0.00 H new ATOM 0 HG2 ARG A 780 -21.364 -5.711 3.032 1.00 0.00 H new ATOM 0 HG3 ARG A 780 -22.070 -7.111 2.249 1.00 0.00 H new ATOM 0 HD2 ARG A 780 -22.788 -8.019 4.406 1.00 0.00 H new ATOM 0 HD3 ARG A 780 -21.967 -6.729 5.262 1.00 0.00 H new ATOM 0 HE ARG A 780 -23.864 -5.644 3.376 1.00 0.00 H new ATOM 0 HH11 ARG A 780 -23.731 -7.346 6.488 1.00 0.00 H new ATOM 0 HH12 ARG A 780 -25.195 -6.568 7.100 1.00 0.00 H new ATOM 0 HH21 ARG A 780 -25.688 -4.599 4.208 1.00 0.00 H new ATOM 0 HH22 ARG A 780 -26.297 -5.018 5.813 1.00 0.00 H new ATOM 1449 N CYS A 781 -20.099 -9.063 0.701 1.00 0.00 N ATOM 1450 CA CYS A 781 -20.614 -9.536 -0.534 1.00 0.00 C ATOM 1451 C CYS A 781 -22.105 -9.774 -0.363 1.00 0.00 C ATOM 1452 O CYS A 781 -22.606 -9.820 0.765 1.00 0.00 O ATOM 1453 CB CYS A 781 -19.869 -10.822 -0.905 1.00 0.00 C ATOM 1454 SG CYS A 781 -20.218 -11.514 -2.565 1.00 0.00 S ATOM 0 H CYS A 781 -19.868 -9.795 1.373 1.00 0.00 H new ATOM 0 HA CYS A 781 -20.470 -8.815 -1.339 1.00 0.00 H new ATOM 0 HB2 CYS A 781 -18.798 -10.630 -0.833 1.00 0.00 H new ATOM 0 HB3 CYS A 781 -20.107 -11.582 -0.161 1.00 0.00 H new ATOM 1459 N ARG A 782 -22.818 -9.891 -1.444 1.00 0.00 N ATOM 1460 CA ARG A 782 -24.234 -10.143 -1.371 1.00 0.00 C ATOM 1461 C ARG A 782 -24.498 -11.630 -1.172 1.00 0.00 C ATOM 1462 O ARG A 782 -25.542 -12.024 -0.657 1.00 0.00 O ATOM 1463 CB ARG A 782 -24.968 -9.563 -2.588 1.00 0.00 C ATOM 1464 CG ARG A 782 -24.496 -10.072 -3.934 1.00 0.00 C ATOM 1465 CD ARG A 782 -25.203 -9.351 -5.066 1.00 0.00 C ATOM 1466 NE ARG A 782 -24.779 -9.840 -6.376 1.00 0.00 N ATOM 1467 CZ ARG A 782 -24.697 -9.102 -7.497 1.00 0.00 C ATOM 1468 NH1 ARG A 782 -25.002 -7.796 -7.479 1.00 0.00 N ATOM 1469 NH2 ARG A 782 -24.305 -9.673 -8.626 1.00 0.00 N ATOM 0 H ARG A 782 -22.445 -9.816 -2.390 1.00 0.00 H new ATOM 0 HA ARG A 782 -24.639 -9.626 -0.501 1.00 0.00 H new ATOM 0 HB2 ARG A 782 -26.031 -9.782 -2.488 1.00 0.00 H new ATOM 0 HB3 ARG A 782 -24.863 -8.478 -2.571 1.00 0.00 H new ATOM 0 HG2 ARG A 782 -23.419 -9.929 -4.024 1.00 0.00 H new ATOM 0 HG3 ARG A 782 -24.683 -11.143 -4.008 1.00 0.00 H new ATOM 0 HD2 ARG A 782 -26.280 -9.481 -4.962 1.00 0.00 H new ATOM 0 HD3 ARG A 782 -25.003 -8.282 -4.996 1.00 0.00 H new ATOM 0 HE ARG A 782 -24.523 -10.825 -6.446 1.00 0.00 H new ATOM 0 HH11 ARG A 782 -25.299 -7.354 -6.609 1.00 0.00 H new ATOM 0 HH12 ARG A 782 -24.936 -7.245 -8.335 1.00 0.00 H new ATOM 0 HH21 ARG A 782 -24.068 -10.665 -8.640 1.00 0.00 H new ATOM 0 HH22 ARG A 782 -24.240 -9.121 -9.481 1.00 0.00 H new ATOM 1483 N GLY A 783 -23.532 -12.447 -1.564 1.00 0.00 N ATOM 1484 CA GLY A 783 -23.624 -13.870 -1.344 1.00 0.00 C ATOM 1485 C GLY A 783 -22.944 -14.290 -0.071 1.00 0.00 C ATOM 1486 O GLY A 783 -23.116 -15.408 0.399 1.00 0.00 O ATOM 0 H GLY A 783 -22.680 -12.143 -2.035 1.00 0.00 H new ATOM 0 HA2 GLY A 783 -24.673 -14.164 -1.308 1.00 0.00 H new ATOM 0 HA3 GLY A 783 -23.174 -14.396 -2.186 1.00 0.00 H new ATOM 1490 N LYS A 784 -22.165 -13.394 0.482 1.00 0.00 N ATOM 1491 CA LYS A 784 -21.442 -13.642 1.713 1.00 0.00 C ATOM 1492 C LYS A 784 -21.679 -12.480 2.634 1.00 0.00 C ATOM 1493 O LYS A 784 -21.026 -11.430 2.493 1.00 0.00 O ATOM 1494 CB LYS A 784 -19.926 -13.752 1.498 1.00 0.00 C ATOM 1495 CG LYS A 784 -19.388 -14.898 0.653 1.00 0.00 C ATOM 1496 CD LYS A 784 -19.668 -14.701 -0.818 1.00 0.00 C ATOM 1497 CE LYS A 784 -18.708 -15.491 -1.676 1.00 0.00 C ATOM 1498 NZ LYS A 784 -17.310 -15.035 -1.483 1.00 0.00 N ATOM 0 H LYS A 784 -22.011 -12.465 0.091 1.00 0.00 H new ATOM 0 HA LYS A 784 -21.800 -14.588 2.120 1.00 0.00 H new ATOM 0 HB2 LYS A 784 -19.588 -12.820 1.044 1.00 0.00 H new ATOM 0 HB3 LYS A 784 -19.457 -13.817 2.480 1.00 0.00 H new ATOM 0 HG2 LYS A 784 -18.313 -14.988 0.808 1.00 0.00 H new ATOM 0 HG3 LYS A 784 -19.837 -15.834 0.985 1.00 0.00 H new ATOM 0 HD2 LYS A 784 -20.691 -15.007 -1.039 1.00 0.00 H new ATOM 0 HD3 LYS A 784 -19.591 -13.642 -1.065 1.00 0.00 H new ATOM 0 HE2 LYS A 784 -18.784 -16.550 -1.430 1.00 0.00 H new ATOM 0 HE3 LYS A 784 -18.985 -15.387 -2.725 1.00 0.00 H new ATOM 0 HZ1 LYS A 784 -16.764 -15.213 -2.350 1.00 0.00 H new ATOM 0 HZ2 LYS A 784 -17.303 -14.017 -1.272 1.00 0.00 H new ATOM 0 HZ3 LYS A 784 -16.881 -15.555 -0.691 1.00 0.00 H new ATOM 1512 N GLU A 785 -22.589 -12.620 3.547 1.00 0.00 N ATOM 1513 CA GLU A 785 -22.918 -11.517 4.394 1.00 0.00 C ATOM 1514 C GLU A 785 -22.027 -11.483 5.633 1.00 0.00 C ATOM 1515 O GLU A 785 -22.297 -12.118 6.655 1.00 0.00 O ATOM 1516 CB GLU A 785 -24.408 -11.480 4.729 1.00 0.00 C ATOM 1517 CG GLU A 785 -24.835 -10.207 5.430 1.00 0.00 C ATOM 1518 CD GLU A 785 -26.313 -10.135 5.644 1.00 0.00 C ATOM 1519 OE1 GLU A 785 -26.812 -10.725 6.627 1.00 0.00 O ATOM 1520 OE2 GLU A 785 -27.016 -9.496 4.829 1.00 0.00 O ATOM 0 H GLU A 785 -23.112 -13.477 3.724 1.00 0.00 H new ATOM 0 HA GLU A 785 -22.714 -10.601 3.840 1.00 0.00 H new ATOM 0 HB2 GLU A 785 -24.983 -11.590 3.809 1.00 0.00 H new ATOM 0 HB3 GLU A 785 -24.652 -12.334 5.361 1.00 0.00 H new ATOM 0 HG2 GLU A 785 -24.329 -10.140 6.393 1.00 0.00 H new ATOM 0 HG3 GLU A 785 -24.515 -9.348 4.841 1.00 0.00 H new ATOM 1527 N GLY A 786 -20.920 -10.830 5.469 1.00 0.00 N ATOM 1528 CA GLY A 786 -19.972 -10.604 6.514 1.00 0.00 C ATOM 1529 C GLY A 786 -18.930 -9.699 5.981 1.00 0.00 C ATOM 1530 O GLY A 786 -18.695 -9.695 4.772 1.00 0.00 O ATOM 0 H GLY A 786 -20.642 -10.426 4.575 1.00 0.00 H new ATOM 0 HA2 GLY A 786 -20.458 -10.160 7.383 1.00 0.00 H new ATOM 0 HA3 GLY A 786 -19.531 -11.545 6.842 1.00 0.00 H new ATOM 1534 N TRP A 787 -18.309 -8.946 6.820 1.00 0.00 N ATOM 1535 CA TRP A 787 -17.400 -7.936 6.362 1.00 0.00 C ATOM 1536 C TRP A 787 -16.001 -8.474 6.320 1.00 0.00 C ATOM 1537 O TRP A 787 -15.547 -9.125 7.250 1.00 0.00 O ATOM 1538 CB TRP A 787 -17.453 -6.717 7.254 1.00 0.00 C ATOM 1539 CG TRP A 787 -18.845 -6.249 7.579 1.00 0.00 C ATOM 1540 CD1 TRP A 787 -19.595 -6.630 8.650 1.00 0.00 C ATOM 1541 CD2 TRP A 787 -19.648 -5.328 6.841 1.00 0.00 C ATOM 1542 NE1 TRP A 787 -20.808 -6.000 8.626 1.00 0.00 N ATOM 1543 CE2 TRP A 787 -20.869 -5.190 7.532 1.00 0.00 C ATOM 1544 CE3 TRP A 787 -19.459 -4.603 5.671 1.00 0.00 C ATOM 1545 CZ2 TRP A 787 -21.887 -4.358 7.089 1.00 0.00 C ATOM 1546 CZ3 TRP A 787 -20.471 -3.781 5.234 1.00 0.00 C ATOM 1547 CH2 TRP A 787 -21.669 -3.662 5.941 1.00 0.00 C ATOM 0 H TRP A 787 -18.410 -9.005 7.833 1.00 0.00 H new ATOM 0 HA TRP A 787 -17.701 -7.643 5.356 1.00 0.00 H new ATOM 0 HB2 TRP A 787 -16.930 -6.939 8.184 1.00 0.00 H new ATOM 0 HB3 TRP A 787 -16.912 -5.903 6.771 1.00 0.00 H new ATOM 0 HD1 TRP A 787 -19.277 -7.329 9.409 1.00 0.00 H new ATOM 0 HE1 TRP A 787 -21.549 -6.118 9.317 1.00 0.00 H new ATOM 0 HE3 TRP A 787 -18.536 -4.683 5.116 1.00 0.00 H new ATOM 0 HZ2 TRP A 787 -22.815 -4.267 7.634 1.00 0.00 H new ATOM 0 HZ3 TRP A 787 -20.336 -3.215 4.324 1.00 0.00 H new ATOM 0 HH2 TRP A 787 -22.439 -3.003 5.568 1.00 0.00 H new ATOM 1558 N ILE A 788 -15.330 -8.193 5.251 1.00 0.00 N ATOM 1559 CA ILE A 788 -13.983 -8.695 5.047 1.00 0.00 C ATOM 1560 C ILE A 788 -12.932 -7.667 5.507 1.00 0.00 C ATOM 1561 O ILE A 788 -11.856 -8.040 5.970 1.00 0.00 O ATOM 1562 CB ILE A 788 -13.743 -9.122 3.552 1.00 0.00 C ATOM 1563 CG1 ILE A 788 -14.694 -10.271 3.118 1.00 0.00 C ATOM 1564 CG2 ILE A 788 -12.293 -9.517 3.294 1.00 0.00 C ATOM 1565 CD1 ILE A 788 -16.115 -9.854 2.774 1.00 0.00 C ATOM 0 H ILE A 788 -15.685 -7.614 4.490 1.00 0.00 H new ATOM 0 HA ILE A 788 -13.871 -9.588 5.662 1.00 0.00 H new ATOM 0 HB ILE A 788 -13.968 -8.244 2.946 1.00 0.00 H new ATOM 0 HG12 ILE A 788 -14.261 -10.769 2.251 1.00 0.00 H new ATOM 0 HG13 ILE A 788 -14.735 -11.007 3.921 1.00 0.00 H new ATOM 0 HG21 ILE A 788 -12.175 -9.804 2.249 1.00 0.00 H new ATOM 0 HG22 ILE A 788 -11.641 -8.672 3.514 1.00 0.00 H new ATOM 0 HG23 ILE A 788 -12.026 -10.358 3.934 1.00 0.00 H new ATOM 0 HD11 ILE A 788 -16.692 -10.732 2.485 1.00 0.00 H new ATOM 0 HD12 ILE A 788 -16.577 -9.386 3.643 1.00 0.00 H new ATOM 0 HD13 ILE A 788 -16.096 -9.144 1.947 1.00 0.00 H new ATOM 1577 N HIS A 789 -13.311 -6.363 5.445 1.00 0.00 N ATOM 1578 CA HIS A 789 -12.429 -5.199 5.832 1.00 0.00 C ATOM 1579 C HIS A 789 -11.376 -4.967 4.754 1.00 0.00 C ATOM 1580 O HIS A 789 -10.605 -5.855 4.455 1.00 0.00 O ATOM 1581 CB HIS A 789 -11.694 -5.402 7.199 1.00 0.00 C ATOM 1582 CG HIS A 789 -12.563 -5.693 8.388 1.00 0.00 C ATOM 1583 ND1 HIS A 789 -13.880 -5.951 8.478 1.00 0.00 N flip ATOM 1584 CD2 HIS A 789 -12.076 -5.776 9.664 1.00 0.00 C flip ATOM 1585 CE1 HIS A 789 -14.165 -6.187 9.790 1.00 0.00 C flip ATOM 1586 NE2 HIS A 789 -13.053 -6.075 10.487 1.00 0.00 N flip ATOM 0 H HIS A 789 -14.236 -6.075 5.126 1.00 0.00 H new ATOM 0 HA HIS A 789 -13.091 -4.340 5.935 1.00 0.00 H new ATOM 0 HB2 HIS A 789 -10.984 -6.221 7.086 1.00 0.00 H new ATOM 0 HB3 HIS A 789 -11.114 -4.504 7.412 1.00 0.00 H new ATOM 0 HD2 HIS A 789 -11.046 -5.620 9.950 1.00 0.00 H new ATOM 0 HE1 HIS A 789 -15.139 -6.426 10.191 1.00 0.00 H new ATOM 0 HE2 HIS A 789 -12.966 -6.200 11.496 1.00 0.00 H new ATOM 1595 N THR A 790 -11.370 -3.806 4.151 1.00 0.00 N ATOM 1596 CA THR A 790 -10.391 -3.509 3.130 1.00 0.00 C ATOM 1597 C THR A 790 -9.947 -2.036 3.197 1.00 0.00 C ATOM 1598 O THR A 790 -10.618 -1.209 3.823 1.00 0.00 O ATOM 1599 CB THR A 790 -10.955 -3.890 1.743 1.00 0.00 C ATOM 1600 OG1 THR A 790 -10.096 -3.493 0.689 1.00 0.00 O ATOM 1601 CG2 THR A 790 -12.345 -3.333 1.548 1.00 0.00 C ATOM 0 H THR A 790 -12.028 -3.052 4.346 1.00 0.00 H new ATOM 0 HA THR A 790 -9.497 -4.107 3.305 1.00 0.00 H new ATOM 0 HB THR A 790 -11.017 -4.978 1.713 1.00 0.00 H new ATOM 0 HG1 THR A 790 -9.741 -4.288 0.240 1.00 0.00 H new ATOM 0 HG21 THR A 790 -12.716 -3.617 0.563 1.00 0.00 H new ATOM 0 HG22 THR A 790 -13.008 -3.733 2.315 1.00 0.00 H new ATOM 0 HG23 THR A 790 -12.316 -2.246 1.625 1.00 0.00 H new ATOM 1609 N VAL A 791 -8.808 -1.741 2.605 1.00 0.00 N ATOM 1610 CA VAL A 791 -8.214 -0.417 2.607 1.00 0.00 C ATOM 1611 C VAL A 791 -8.040 0.065 1.165 1.00 0.00 C ATOM 1612 O VAL A 791 -7.633 -0.704 0.299 1.00 0.00 O ATOM 1613 CB VAL A 791 -6.824 -0.463 3.304 1.00 0.00 C ATOM 1614 CG1 VAL A 791 -6.181 0.911 3.362 1.00 0.00 C ATOM 1615 CG2 VAL A 791 -6.941 -1.063 4.701 1.00 0.00 C ATOM 0 H VAL A 791 -8.255 -2.431 2.096 1.00 0.00 H new ATOM 0 HA VAL A 791 -8.867 0.268 3.148 1.00 0.00 H new ATOM 0 HB VAL A 791 -6.177 -1.104 2.705 1.00 0.00 H new ATOM 0 HG11 VAL A 791 -5.212 0.839 3.856 1.00 0.00 H new ATOM 0 HG12 VAL A 791 -6.045 1.292 2.350 1.00 0.00 H new ATOM 0 HG13 VAL A 791 -6.824 1.590 3.922 1.00 0.00 H new ATOM 0 HG21 VAL A 791 -5.958 -1.086 5.171 1.00 0.00 H new ATOM 0 HG22 VAL A 791 -7.617 -0.455 5.303 1.00 0.00 H new ATOM 0 HG23 VAL A 791 -7.333 -2.078 4.630 1.00 0.00 H new ATOM 1625 N CYS A 792 -8.390 1.312 0.911 1.00 0.00 N ATOM 1626 CA CYS A 792 -8.251 1.909 -0.418 1.00 0.00 C ATOM 1627 C CYS A 792 -6.791 2.178 -0.740 1.00 0.00 C ATOM 1628 O CYS A 792 -6.190 3.137 -0.276 1.00 0.00 O ATOM 1629 CB CYS A 792 -9.044 3.202 -0.511 1.00 0.00 C ATOM 1630 SG CYS A 792 -8.997 4.054 -2.137 1.00 0.00 S ATOM 0 H CYS A 792 -8.778 1.943 1.612 1.00 0.00 H new ATOM 0 HA CYS A 792 -8.645 1.199 -1.145 1.00 0.00 H new ATOM 0 HB2 CYS A 792 -10.084 2.987 -0.265 1.00 0.00 H new ATOM 0 HB3 CYS A 792 -8.672 3.889 0.249 1.00 0.00 H new ATOM 1635 N ILE A 793 -6.250 1.362 -1.526 1.00 0.00 N ATOM 1636 CA ILE A 793 -4.893 1.455 -1.927 1.00 0.00 C ATOM 1637 C ILE A 793 -4.845 2.099 -3.281 1.00 0.00 C ATOM 1638 O ILE A 793 -4.822 1.413 -4.304 1.00 0.00 O ATOM 1639 CB ILE A 793 -4.199 0.070 -1.982 1.00 0.00 C ATOM 1640 CG1 ILE A 793 -4.288 -0.631 -0.615 1.00 0.00 C ATOM 1641 CG2 ILE A 793 -2.735 0.227 -2.401 1.00 0.00 C ATOM 1642 CD1 ILE A 793 -3.626 0.119 0.532 1.00 0.00 C ATOM 0 H ILE A 793 -6.745 0.570 -1.936 1.00 0.00 H new ATOM 0 HA ILE A 793 -4.356 2.051 -1.189 1.00 0.00 H new ATOM 0 HB ILE A 793 -4.712 -0.545 -2.722 1.00 0.00 H new ATOM 0 HG12 ILE A 793 -5.339 -0.787 -0.370 1.00 0.00 H new ATOM 0 HG13 ILE A 793 -3.831 -1.617 -0.698 1.00 0.00 H new ATOM 0 HG21 ILE A 793 -2.259 -0.753 -2.436 1.00 0.00 H new ATOM 0 HG22 ILE A 793 -2.686 0.689 -3.387 1.00 0.00 H new ATOM 0 HG23 ILE A 793 -2.215 0.857 -1.679 1.00 0.00 H new ATOM 0 HD11 ILE A 793 -3.740 -0.452 1.454 1.00 0.00 H new ATOM 0 HD12 ILE A 793 -2.566 0.252 0.316 1.00 0.00 H new ATOM 0 HD13 ILE A 793 -4.097 1.095 0.649 1.00 0.00 H new ATOM 1654 N ASN A 794 -4.971 3.427 -3.273 1.00 0.00 N ATOM 1655 CA ASN A 794 -4.870 4.259 -4.477 1.00 0.00 C ATOM 1656 C ASN A 794 -5.767 3.737 -5.606 1.00 0.00 C ATOM 1657 O ASN A 794 -5.280 3.202 -6.610 1.00 0.00 O ATOM 1658 CB ASN A 794 -3.430 4.339 -4.998 1.00 0.00 C ATOM 1659 CG ASN A 794 -2.409 4.950 -4.099 1.00 0.00 C ATOM 1660 OD1 ASN A 794 -2.648 5.044 -2.792 1.00 0.00 O flip ATOM 1661 ND2 ASN A 794 -1.409 5.407 -4.595 1.00 0.00 N flip ATOM 0 H ASN A 794 -5.148 3.962 -2.423 1.00 0.00 H new ATOM 0 HA ASN A 794 -5.202 5.254 -4.180 1.00 0.00 H new ATOM 0 HB2 ASN A 794 -3.103 3.328 -5.241 1.00 0.00 H new ATOM 0 HB3 ASN A 794 -3.440 4.904 -5.930 1.00 0.00 H new ATOM 0 HD21 ASN A 794 -1.252 5.320 -5.599 1.00 0.00 H new ATOM 0 HD22 ASN A 794 -0.720 5.880 -4.010 1.00 0.00 H new ATOM 1668 N GLY A 795 -7.056 3.846 -5.424 1.00 0.00 N ATOM 1669 CA GLY A 795 -7.987 3.423 -6.449 1.00 0.00 C ATOM 1670 C GLY A 795 -8.234 1.921 -6.481 1.00 0.00 C ATOM 1671 O GLY A 795 -8.925 1.430 -7.373 1.00 0.00 O ATOM 0 H GLY A 795 -7.489 4.222 -4.581 1.00 0.00 H new ATOM 0 HA2 GLY A 795 -8.938 3.934 -6.295 1.00 0.00 H new ATOM 0 HA3 GLY A 795 -7.609 3.739 -7.421 1.00 0.00 H new ATOM 1675 N ARG A 796 -7.699 1.197 -5.527 1.00 0.00 N ATOM 1676 CA ARG A 796 -7.876 -0.231 -5.483 1.00 0.00 C ATOM 1677 C ARG A 796 -8.094 -0.588 -4.042 1.00 0.00 C ATOM 1678 O ARG A 796 -7.878 0.219 -3.184 1.00 0.00 O ATOM 1679 CB ARG A 796 -6.626 -0.942 -5.974 1.00 0.00 C ATOM 1680 CG ARG A 796 -6.842 -2.405 -6.358 1.00 0.00 C ATOM 1681 CD ARG A 796 -5.542 -3.087 -6.629 1.00 0.00 C ATOM 1682 NE ARG A 796 -5.709 -4.520 -6.860 1.00 0.00 N ATOM 1683 CZ ARG A 796 -4.872 -5.460 -6.421 1.00 0.00 C ATOM 1684 NH1 ARG A 796 -3.772 -5.123 -5.761 1.00 0.00 N ATOM 1685 NH2 ARG A 796 -5.138 -6.747 -6.638 1.00 0.00 N ATOM 0 H ARG A 796 -7.135 1.578 -4.768 1.00 0.00 H new ATOM 0 HA ARG A 796 -8.711 -0.530 -6.116 1.00 0.00 H new ATOM 0 HB2 ARG A 796 -6.234 -0.406 -6.838 1.00 0.00 H new ATOM 0 HB3 ARG A 796 -5.865 -0.892 -5.196 1.00 0.00 H new ATOM 0 HG2 ARG A 796 -7.367 -2.922 -5.554 1.00 0.00 H new ATOM 0 HG3 ARG A 796 -7.477 -2.462 -7.242 1.00 0.00 H new ATOM 0 HD2 ARG A 796 -5.070 -2.633 -7.500 1.00 0.00 H new ATOM 0 HD3 ARG A 796 -4.870 -2.933 -5.785 1.00 0.00 H new ATOM 0 HE ARG A 796 -6.523 -4.822 -7.395 1.00 0.00 H new ATOM 0 HH11 ARG A 796 -3.563 -4.140 -5.587 1.00 0.00 H new ATOM 0 HH12 ARG A 796 -3.135 -5.847 -5.428 1.00 0.00 H new ATOM 0 HH21 ARG A 796 -5.984 -7.015 -7.141 1.00 0.00 H new ATOM 0 HH22 ARG A 796 -4.496 -7.464 -6.301 1.00 0.00 H new ATOM 1699 N TRP A 797 -8.482 -1.763 -3.782 1.00 0.00 N ATOM 1700 CA TRP A 797 -8.733 -2.185 -2.453 1.00 0.00 C ATOM 1701 C TRP A 797 -7.696 -3.207 -2.016 1.00 0.00 C ATOM 1702 O TRP A 797 -7.003 -3.799 -2.861 1.00 0.00 O ATOM 1703 CB TRP A 797 -10.123 -2.766 -2.403 1.00 0.00 C ATOM 1704 CG TRP A 797 -11.185 -1.740 -2.645 1.00 0.00 C ATOM 1705 CD1 TRP A 797 -12.002 -1.618 -3.738 1.00 0.00 C ATOM 1706 CD2 TRP A 797 -11.504 -0.661 -1.780 1.00 0.00 C ATOM 1707 NE1 TRP A 797 -12.831 -0.535 -3.579 1.00 0.00 N ATOM 1708 CE2 TRP A 797 -12.535 0.072 -2.381 1.00 0.00 C ATOM 1709 CE3 TRP A 797 -11.015 -0.249 -0.542 1.00 0.00 C ATOM 1710 CZ2 TRP A 797 -13.078 1.196 -1.781 1.00 0.00 C ATOM 1711 CZ3 TRP A 797 -11.548 0.865 0.048 1.00 0.00 C ATOM 1712 CH2 TRP A 797 -12.563 1.574 -0.565 1.00 0.00 C ATOM 0 H TRP A 797 -8.641 -2.480 -4.489 1.00 0.00 H new ATOM 0 HA TRP A 797 -8.663 -1.341 -1.767 1.00 0.00 H new ATOM 0 HB2 TRP A 797 -10.210 -3.556 -3.149 1.00 0.00 H new ATOM 0 HB3 TRP A 797 -10.285 -3.228 -1.429 1.00 0.00 H new ATOM 0 HD1 TRP A 797 -11.995 -2.275 -4.595 1.00 0.00 H new ATOM 0 HE1 TRP A 797 -13.547 -0.231 -4.239 1.00 0.00 H new ATOM 0 HE3 TRP A 797 -10.226 -0.802 -0.054 1.00 0.00 H new ATOM 0 HZ2 TRP A 797 -13.875 1.753 -2.251 1.00 0.00 H new ATOM 0 HZ3 TRP A 797 -11.170 1.194 1.005 1.00 0.00 H new ATOM 0 HH2 TRP A 797 -12.962 2.449 -0.075 1.00 0.00 H new ATOM 1723 N ASP A 798 -7.572 -3.391 -0.720 1.00 0.00 N ATOM 1724 CA ASP A 798 -6.668 -4.388 -0.135 1.00 0.00 C ATOM 1725 C ASP A 798 -7.257 -4.850 1.180 1.00 0.00 C ATOM 1726 O ASP A 798 -7.291 -4.080 2.135 1.00 0.00 O ATOM 1727 CB ASP A 798 -5.293 -3.794 0.109 1.00 0.00 C ATOM 1728 CG ASP A 798 -4.231 -4.804 0.515 1.00 0.00 C ATOM 1729 OD1 ASP A 798 -4.063 -5.080 1.733 1.00 0.00 O ATOM 1730 OD2 ASP A 798 -3.491 -5.289 -0.383 1.00 0.00 O ATOM 0 H ASP A 798 -8.095 -2.855 -0.027 1.00 0.00 H new ATOM 0 HA ASP A 798 -6.560 -5.225 -0.825 1.00 0.00 H new ATOM 0 HB2 ASP A 798 -4.965 -3.286 -0.798 1.00 0.00 H new ATOM 0 HB3 ASP A 798 -5.372 -3.036 0.888 1.00 0.00 H new ATOM 1735 N PRO A 799 -7.810 -6.071 1.245 1.00 0.00 N ATOM 1736 CA PRO A 799 -7.904 -6.980 0.103 1.00 0.00 C ATOM 1737 C PRO A 799 -8.861 -6.442 -0.947 1.00 0.00 C ATOM 1738 O PRO A 799 -9.902 -5.849 -0.614 1.00 0.00 O ATOM 1739 CB PRO A 799 -8.459 -8.272 0.701 1.00 0.00 C ATOM 1740 CG PRO A 799 -9.137 -7.854 1.954 1.00 0.00 C ATOM 1741 CD PRO A 799 -8.396 -6.654 2.452 1.00 0.00 C ATOM 0 HA PRO A 799 -6.943 -7.115 -0.394 1.00 0.00 H new ATOM 0 HB2 PRO A 799 -9.156 -8.756 0.017 1.00 0.00 H new ATOM 0 HB3 PRO A 799 -7.662 -8.988 0.903 1.00 0.00 H new ATOM 0 HG2 PRO A 799 -10.184 -7.615 1.768 1.00 0.00 H new ATOM 0 HG3 PRO A 799 -9.119 -8.656 2.692 1.00 0.00 H new ATOM 0 HD2 PRO A 799 -9.064 -5.951 2.950 1.00 0.00 H new ATOM 0 HD3 PRO A 799 -7.628 -6.931 3.174 1.00 0.00 H new ATOM 1749 N GLU A 800 -8.466 -6.580 -2.180 1.00 0.00 N ATOM 1750 CA GLU A 800 -9.213 -6.120 -3.311 1.00 0.00 C ATOM 1751 C GLU A 800 -10.620 -6.710 -3.284 1.00 0.00 C ATOM 1752 O GLU A 800 -10.797 -7.945 -3.279 1.00 0.00 O ATOM 1753 CB GLU A 800 -8.489 -6.521 -4.568 1.00 0.00 C ATOM 1754 CG GLU A 800 -9.027 -5.895 -5.811 1.00 0.00 C ATOM 1755 CD GLU A 800 -8.412 -6.488 -7.033 1.00 0.00 C ATOM 1756 OE1 GLU A 800 -8.450 -7.710 -7.192 1.00 0.00 O ATOM 1757 OE2 GLU A 800 -7.890 -5.735 -7.868 1.00 0.00 O ATOM 0 H GLU A 800 -7.586 -7.031 -2.432 1.00 0.00 H new ATOM 0 HA GLU A 800 -9.303 -5.034 -3.281 1.00 0.00 H new ATOM 0 HB2 GLU A 800 -7.436 -6.256 -4.468 1.00 0.00 H new ATOM 0 HB3 GLU A 800 -8.536 -7.605 -4.671 1.00 0.00 H new ATOM 0 HG2 GLU A 800 -10.108 -6.026 -5.847 1.00 0.00 H new ATOM 0 HG3 GLU A 800 -8.836 -4.822 -5.791 1.00 0.00 H new ATOM 1764 N VAL A 801 -11.591 -5.829 -3.265 1.00 0.00 N ATOM 1765 CA VAL A 801 -12.984 -6.191 -3.127 1.00 0.00 C ATOM 1766 C VAL A 801 -13.479 -7.039 -4.296 1.00 0.00 C ATOM 1767 O VAL A 801 -13.371 -6.641 -5.471 1.00 0.00 O ATOM 1768 CB VAL A 801 -13.881 -4.934 -2.915 1.00 0.00 C ATOM 1769 CG1 VAL A 801 -15.313 -5.279 -2.880 1.00 0.00 C ATOM 1770 CG2 VAL A 801 -13.484 -4.208 -1.657 1.00 0.00 C ATOM 0 H VAL A 801 -11.435 -4.824 -3.346 1.00 0.00 H new ATOM 0 HA VAL A 801 -13.063 -6.809 -2.233 1.00 0.00 H new ATOM 0 HB VAL A 801 -13.724 -4.275 -3.769 1.00 0.00 H new ATOM 0 HG11 VAL A 801 -15.902 -4.374 -2.731 1.00 0.00 H new ATOM 0 HG12 VAL A 801 -15.598 -5.746 -3.823 1.00 0.00 H new ATOM 0 HG13 VAL A 801 -15.500 -5.973 -2.061 1.00 0.00 H new ATOM 0 HG21 VAL A 801 -14.121 -3.333 -1.525 1.00 0.00 H new ATOM 0 HG22 VAL A 801 -13.599 -4.873 -0.801 1.00 0.00 H new ATOM 0 HG23 VAL A 801 -12.444 -3.891 -1.733 1.00 0.00 H new ATOM 1780 N ASN A 802 -13.991 -8.210 -3.958 1.00 0.00 N ATOM 1781 CA ASN A 802 -14.512 -9.156 -4.914 1.00 0.00 C ATOM 1782 C ASN A 802 -15.769 -9.795 -4.310 1.00 0.00 C ATOM 1783 O ASN A 802 -15.800 -10.087 -3.112 1.00 0.00 O ATOM 1784 CB ASN A 802 -13.473 -10.259 -5.185 1.00 0.00 C ATOM 1785 CG ASN A 802 -13.893 -11.266 -6.256 1.00 0.00 C ATOM 1786 OD1 ASN A 802 -14.440 -10.796 -7.344 1.00 0.00 O flip ATOM 1787 ND2 ASN A 802 -13.645 -12.465 -6.127 1.00 0.00 N flip ATOM 0 H ASN A 802 -14.055 -8.530 -2.992 1.00 0.00 H new ATOM 0 HA ASN A 802 -14.743 -8.648 -5.851 1.00 0.00 H new ATOM 0 HB2 ASN A 802 -12.536 -9.793 -5.488 1.00 0.00 H new ATOM 0 HB3 ASN A 802 -13.277 -10.794 -4.256 1.00 0.00 H new ATOM 0 HD21 ASN A 802 -13.217 -12.808 -5.267 1.00 0.00 H new ATOM 0 HD22 ASN A 802 -13.867 -13.116 -6.880 1.00 0.00 H new ATOM 1794 N CYS A 803 -16.790 -9.973 -5.101 1.00 0.00 N ATOM 1795 CA CYS A 803 -18.039 -10.573 -4.644 1.00 0.00 C ATOM 1796 C CYS A 803 -18.455 -11.666 -5.631 1.00 0.00 C ATOM 1797 O CYS A 803 -19.631 -12.036 -5.761 1.00 0.00 O ATOM 1798 CB CYS A 803 -19.087 -9.475 -4.554 1.00 0.00 C ATOM 1799 SG CYS A 803 -20.669 -9.891 -3.702 1.00 0.00 S ATOM 0 H CYS A 803 -16.792 -9.709 -6.086 1.00 0.00 H new ATOM 0 HA CYS A 803 -17.924 -11.031 -3.662 1.00 0.00 H new ATOM 0 HB2 CYS A 803 -18.641 -8.623 -4.042 1.00 0.00 H new ATOM 0 HB3 CYS A 803 -19.324 -9.150 -5.567 1.00 0.00 H new ATOM 1804 N SER A 804 -17.484 -12.168 -6.321 1.00 0.00 N ATOM 1805 CA SER A 804 -17.685 -13.260 -7.239 1.00 0.00 C ATOM 1806 C SER A 804 -17.752 -14.579 -6.475 1.00 0.00 C ATOM 1807 O SER A 804 -18.869 -15.078 -6.246 1.00 0.00 O ATOM 1808 CB SER A 804 -16.586 -13.292 -8.281 1.00 0.00 C ATOM 1809 OG SER A 804 -16.529 -12.056 -8.989 1.00 0.00 O ATOM 1810 OXT SER A 804 -16.696 -15.101 -6.056 1.00 0.00 O ATOM 0 H SER A 804 -16.521 -11.836 -6.269 1.00 0.00 H new ATOM 0 HA SER A 804 -18.632 -13.113 -7.758 1.00 0.00 H new ATOM 0 HB2 SER A 804 -15.627 -13.486 -7.800 1.00 0.00 H new ATOM 0 HB3 SER A 804 -16.764 -14.110 -8.980 1.00 0.00 H new ATOM 0 HG SER A 804 -15.861 -11.472 -8.574 1.00 0.00 H new TER 1816 SER A 804